mirror of
https://github.com/QuantumPackage/qp2.git
synced 2024-11-04 21:23:56 +01:00
850 lines
38 KiB
Plaintext
850 lines
38 KiB
Plaintext
|
SCANDIUM
|
||
|
S 20
|
||
|
1 4789458.0000000 0.0000040
|
||
|
2 717138.0000000 0.0000350
|
||
|
3 163199.4000000 0.0001820
|
||
|
4 46226.0700000 0.0007680
|
||
|
5 15081.0300000 0.0027890
|
||
|
6 5444.4930000 0.0090270
|
||
|
7 2123.4480000 0.0263500
|
||
|
8 880.5910000 0.0688820
|
||
|
9 383.7729000 0.1556330
|
||
|
10 174.1198000 0.2817100
|
||
|
11 81.5518300 0.3481800
|
||
|
12 38.7658700 0.2193610
|
||
|
13 17.2296200 0.0389150
|
||
|
14 8.43034800 -0.0020840
|
||
|
15 4.10581900 0.0017110
|
||
|
16 1.80662500 -0.0007990
|
||
|
17 0.870423000 0.0003600
|
||
|
18 0.396841000 -0.0001520
|
||
|
19 0.095711000 0.0000610
|
||
|
20 0.048247000 -0.0000480
|
||
|
S 20
|
||
|
1 4789458.0000000 -0.0000010
|
||
|
2 717138.0000000 -0.0000100
|
||
|
3 163199.4000000 -0.0000530
|
||
|
4 46226.0700000 -0.0002250
|
||
|
5 15081.0300000 -0.0008200
|
||
|
6 5444.4930000 -0.0026660
|
||
|
7 2123.4480000 -0.0079010
|
||
|
8 880.5910000 -0.0212590
|
||
|
9 383.7729000 -0.0514410
|
||
|
10 174.1198000 -0.1064140
|
||
|
11 81.5518300 -0.1735290
|
||
|
12 38.7658700 -0.1532720
|
||
|
13 17.2296200 0.1315640
|
||
|
14 8.43034800 0.5369410
|
||
|
15 4.10581900 0.4348940
|
||
|
16 1.80662500 0.0674860
|
||
|
17 0.870423000 -0.0027360
|
||
|
18 0.396841000 0.0020550
|
||
|
19 0.095711000 -0.0005000
|
||
|
20 0.048247000 0.0003920
|
||
|
S 19
|
||
|
1 717138.0000000 0.0000040
|
||
|
2 163199.4000000 0.0000180
|
||
|
3 46226.0700000 0.0000790
|
||
|
4 15081.0300000 0.0002820
|
||
|
5 5444.4930000 0.0009290
|
||
|
6 2123.4480000 0.0027470
|
||
|
7 880.5910000 0.0074180
|
||
|
8 383.7729000 0.0181180
|
||
|
9 174.1198000 0.0379710
|
||
|
10 81.5518300 0.0643440
|
||
|
11 38.7658700 0.0593250
|
||
|
12 17.2296200 -0.0556380
|
||
|
13 8.43034800 -0.3071940
|
||
|
14 4.10581900 -0.3996940
|
||
|
15 1.80662500 0.1576640
|
||
|
16 0.870423000 0.6940990
|
||
|
17 0.396841000 0.3980330
|
||
|
18 0.095711000 0.0231070
|
||
|
19 0.048247000 -0.0089200
|
||
|
S 19
|
||
|
1 717138.0000000 -0.0000010
|
||
|
2 163199.4000000 -0.0000050
|
||
|
3 46226.0700000 -0.0000190
|
||
|
4 15081.0300000 -0.0000700
|
||
|
5 5444.4930000 -0.0002280
|
||
|
6 2123.4480000 -0.0006800
|
||
|
7 880.5910000 -0.0018320
|
||
|
8 383.7729000 -0.0044760
|
||
|
9 174.1198000 -0.0094020
|
||
|
10 81.5518300 -0.0159390
|
||
|
11 38.7658700 -0.0148430
|
||
|
12 17.2296200 0.0140910
|
||
|
13 8.43034800 0.0800850
|
||
|
14 4.10581900 0.1110910
|
||
|
15 1.80662500 -0.0561130
|
||
|
16 0.870423000 -0.2414050
|
||
|
17 0.396841000 -0.2967100
|
||
|
18 0.095711000 0.3310090
|
||
|
19 0.048247000 0.6307610
|
||
|
S 20
|
||
|
1 4789458.0000000 -0.0000100
|
||
|
2 717138.0000000 0.0000810
|
||
|
3 163199.4000000 -0.0000520
|
||
|
4 46226.0700000 -0.0000150
|
||
|
5 15081.0300000 -0.0001280
|
||
|
6 5444.4930000 -0.0003690
|
||
|
7 2123.4480000 -0.0011710
|
||
|
8 880.5910000 -0.0029350
|
||
|
9 383.7729000 -0.0078780
|
||
|
10 174.1198000 -0.0145410
|
||
|
11 81.5518300 -0.0297040
|
||
|
12 38.7658700 -0.0180580
|
||
|
13 17.2296200 0.0058640
|
||
|
14 8.43034800 0.1801430
|
||
|
15 4.10581900 0.1175170
|
||
|
16 1.80662500 0.0544810
|
||
|
17 0.870423000 -0.9204520
|
||
|
18 0.396841000 0.1343350
|
||
|
19 0.095711000 2.1416410
|
||
|
20 0.048247000 -1.1651950
|
||
|
S 20
|
||
|
1 4789458.0000000 0.0000110
|
||
|
2 717138.0000000 -0.0000560
|
||
|
3 163199.4000000 0.0001400
|
||
|
4 46226.0700000 -0.0006310
|
||
|
5 15081.0300000 0.0016770
|
||
|
6 5444.4930000 -0.0078970
|
||
|
7 2123.4480000 0.0095150
|
||
|
8 880.5910000 0.0003610
|
||
|
9 383.7729000 0.0153950
|
||
|
10 174.1198000 0.0209310
|
||
|
11 81.5518300 0.0516960
|
||
|
12 38.7658700 0.0215480
|
||
|
13 17.2296200 0.0106070
|
||
|
14 8.43034800 -0.3528430
|
||
|
15 4.10581900 -0.1409830
|
||
|
16 1.80662500 -0.0959880
|
||
|
17 0.870423000 2.3785830
|
||
|
18 0.396841000 -2.5788460
|
||
|
19 0.095711000 -0.3706990
|
||
|
20 0.048247000 2.8667080
|
||
|
S 1
|
||
|
1 0.022661000 1.0000000
|
||
|
P 15
|
||
|
1 7118.9870000 0.0000900
|
||
|
2 1685.9150000 0.0007950
|
||
|
3 547.4592000 0.0045010
|
||
|
4 209.0187000 0.0190160
|
||
|
5 88.2263800 0.0629700
|
||
|
6 39.9087500 0.1604310
|
||
|
7 18.8517200 0.2975260
|
||
|
8 9.14176300 0.3682280
|
||
|
9 4.50391400 0.2343540
|
||
|
10 2.14309200 0.0488860
|
||
|
11 1.00761100 0.0007460
|
||
|
12 0.463154000 0.0007680
|
||
|
13 0.193060000 -0.0002540
|
||
|
14 0.077220000 0.0001140
|
||
|
15 0.030890000 -0.0000560
|
||
|
P 15
|
||
|
1 7118.9870000 -0.0000300
|
||
|
2 1685.9150000 -0.0002620
|
||
|
3 547.4592000 -0.0014830
|
||
|
4 209.0187000 -0.0063390
|
||
|
5 88.2263800 -0.0213110
|
||
|
6 39.9087500 -0.0563290
|
||
|
7 18.8517200 -0.1079740
|
||
|
8 9.14176300 -0.1445140
|
||
|
9 4.50391400 -0.0560840
|
||
|
10 2.14309200 0.2396690
|
||
|
11 1.00761100 0.4746320
|
||
|
12 0.463154000 0.3647390
|
||
|
13 0.193060000 0.0777780
|
||
|
14 0.077220000 -0.0015240
|
||
|
15 0.030890000 0.0022560
|
||
|
P 15
|
||
|
1 7118.9870000 0.0000090
|
||
|
2 1685.9150000 0.0000760
|
||
|
3 547.4592000 0.0004420
|
||
|
4 209.0187000 0.0018480
|
||
|
5 88.2263800 0.0063640
|
||
|
6 39.9087500 0.0164300
|
||
|
7 18.8517200 0.0326840
|
||
|
8 9.14176300 0.0417770
|
||
|
9 4.50391400 0.0191990
|
||
|
10 2.14309200 -0.0891780
|
||
|
11 1.00761100 -0.1527690
|
||
|
12 0.463154000 -0.2189900
|
||
|
13 0.193060000 0.2279570
|
||
|
14 0.077220000 0.7693560
|
||
|
15 0.030890000 0.1611950
|
||
|
P 15
|
||
|
1 7118.9870000 0.0004540
|
||
|
2 1685.9150000 -0.0023100
|
||
|
3 547.4592000 0.0022250
|
||
|
4 209.0187000 0.0033960
|
||
|
5 88.2263800 0.0122400
|
||
|
6 39.9087500 0.0356370
|
||
|
7 18.8517200 0.0595040
|
||
|
8 9.14176300 0.1051300
|
||
|
9 4.50391400 0.0117120
|
||
|
10 2.14309200 -0.1408420
|
||
|
11 1.00761100 -0.6411810
|
||
|
12 0.463154000 0.1221520
|
||
|
13 0.193060000 1.3953750
|
||
|
14 0.077220000 -0.7062790
|
||
|
15 0.030890000 -0.4300300
|
||
|
P 15
|
||
|
1 7118.9870000 -0.0005020
|
||
|
2 1685.9150000 0.0020750
|
||
|
3 547.4592000 -0.0066550
|
||
|
4 209.0187000 0.0187800
|
||
|
5 88.2263800 -0.0726120
|
||
|
6 39.9087500 0.1181100
|
||
|
7 18.8517200 0.0432120
|
||
|
8 9.14176300 0.1446660
|
||
|
9 4.50391400 0.0822290
|
||
|
10 2.14309200 -0.3699950
|
||
|
11 1.00761100 -1.2279850
|
||
|
12 0.463154000 2.4506950
|
||
|
13 0.193060000 -1.2087560
|
||
|
14 0.077220000 -0.6586530
|
||
|
15 0.030890000 1.1267960
|
||
|
P 1
|
||
|
1 0.012360000 1.0000000
|
||
|
D 9
|
||
|
1 73.5186800 0.0019940
|
||
|
2 21.7610000 0.0144910
|
||
|
3 7.92175500 0.0560450
|
||
|
4 3.18420000 0.1504840
|
||
|
5 1.34262100 0.2674420
|
||
|
6 0.561524000 0.3329810
|
||
|
7 0.227705000 0.3318750
|
||
|
8 0.085241000 0.2165330
|
||
|
9 0.034100000 0.0502200
|
||
|
D 9
|
||
|
1 73.5186800 -0.0020560
|
||
|
2 21.7610000 -0.0151300
|
||
|
3 7.92175500 -0.0585890
|
||
|
4 3.18420000 -0.1600760
|
||
|
5 1.34262100 -0.2654460
|
||
|
6 0.561524000 -0.2817790
|
||
|
7 0.227705000 0.1431640
|
||
|
8 0.085241000 0.5984990
|
||
|
9 0.034100000 0.2648190
|
||
|
D 9
|
||
|
1 73.5186800 -0.0022580
|
||
|
2 21.7610000 -0.0218000
|
||
|
3 7.92175500 -0.0725690
|
||
|
4 3.18420000 -0.2222150
|
||
|
5 1.34262100 -0.3386620
|
||
|
6 0.561524000 -0.0198920
|
||
|
7 0.227705000 0.8645120
|
||
|
8 0.085241000 -0.1586060
|
||
|
9 0.034100000 -0.6502150
|
||
|
D 9
|
||
|
1 73.5186800 0.0235340
|
||
|
2 21.7610000 -0.1037070
|
||
|
3 7.92175500 0.1876500
|
||
|
4 3.18420000 0.2522430
|
||
|
5 1.34262100 0.4588710
|
||
|
6 0.561524000 -0.9555000
|
||
|
7 0.227705000 0.0005320
|
||
|
8 0.085241000 1.0895050
|
||
|
9 0.034100000 -1.0172180
|
||
|
F 6
|
||
|
1 2.96460000 0.0343030
|
||
|
2 1.18590000 0.1016390
|
||
|
3 0.474300000 0.3239780
|
||
|
4 0.189700000 0.5165980
|
||
|
5 0.075900000 0.2940030
|
||
|
6 0.030400000 0.0266410
|
||
|
F 6
|
||
|
1 2.96460000 0.1290820
|
||
|
2 1.18590000 0.3169450
|
||
|
3 0.474300000 0.5774210
|
||
|
4 0.189700000 -0.2135030
|
||
|
5 0.075900000 -0.5582270
|
||
|
6 0.030400000 -0.0591280
|
||
|
F 6
|
||
|
1 2.96460000 -0.2450820
|
||
|
2 1.18590000 -0.5126480
|
||
|
3 0.474300000 0.0650000
|
||
|
4 0.189700000 0.9034580
|
||
|
5 0.075900000 -0.8318230
|
||
|
6 0.030400000 -0.1293200
|
||
|
G 4
|
||
|
1 1.42280000 0.0983400
|
||
|
2 0.569100000 0.3578380
|
||
|
3 0.227600000 0.5681720
|
||
|
4 0.091060000 0.2523340
|
||
|
G 4
|
||
|
1 1.42280000 1.2021280
|
||
|
2 0.569100000 -0.5474770
|
||
|
3 0.227600000 0.0292010
|
||
|
4 0.091060000 -0.0998900
|
||
|
|
||
|
TITANIUM
|
||
|
S 20
|
||
|
1 5309148.1000000 0.0000040
|
||
|
2 794951.6500000 0.0000340
|
||
|
3 180907.5600000 0.0001800
|
||
|
4 51241.9330000 0.0007590
|
||
|
5 16717.4490000 0.0027570
|
||
|
6 6035.2659000 0.0089250
|
||
|
7 2353.8571000 0.0260620
|
||
|
8 976.1464600 0.0681900
|
||
|
9 425.4356300 0.1543490
|
||
|
10 193.0467700 0.2802820
|
||
|
11 90.4393690 0.3484000
|
||
|
12 43.0207130 0.2217050
|
||
|
13 19.1905550 0.0400180
|
||
|
14 9.42571640 -0.0021380
|
||
|
15 4.60524340 0.0017220
|
||
|
16 2.03783430 -0.0008020
|
||
|
17 0.980031800 0.0003560
|
||
|
18 0.445625400 -0.0001480
|
||
|
19 0.106417000 0.0000570
|
||
|
20 0.052570500 -0.0000440
|
||
|
S 20
|
||
|
1 5309148.1000000 -0.0000010
|
||
|
2 794951.6500000 -0.0000100
|
||
|
3 180907.5600000 -0.0000530
|
||
|
4 51241.9330000 -0.0002240
|
||
|
5 16717.4490000 -0.0008180
|
||
|
6 6035.2659000 -0.0026590
|
||
|
7 2353.8571000 -0.0078790
|
||
|
8 976.1464600 -0.0212220
|
||
|
9 425.4356300 -0.0514220
|
||
|
10 193.0467700 -0.1067020
|
||
|
11 90.4393690 -0.1746860
|
||
|
12 43.0207130 -0.1560410
|
||
|
13 19.1905550 0.1293230
|
||
|
14 9.42571640 0.5384640
|
||
|
15 4.60524340 0.4357080
|
||
|
16 2.03783430 0.0681170
|
||
|
17 0.980031800 -0.0024360
|
||
|
18 0.445625400 0.0019870
|
||
|
19 0.106417000 -0.0004560
|
||
|
20 0.052570500 0.0003540
|
||
|
S 19
|
||
|
1 794951.6500000 0.0000040
|
||
|
2 180907.5600000 0.0000180
|
||
|
3 51241.9330000 0.0000810
|
||
|
4 16717.4490000 0.0002890
|
||
|
5 6035.2659000 0.0009510
|
||
|
6 2353.8571000 0.0028120
|
||
|
7 976.1464600 0.0076020
|
||
|
8 425.4356300 0.0185920
|
||
|
9 193.0467700 0.0390850
|
||
|
10 90.4393690 0.0664980
|
||
|
11 43.0207130 0.0620460
|
||
|
12 19.1905550 -0.0562490
|
||
|
13 9.42571640 -0.3180890
|
||
|
14 4.60524340 -0.4058270
|
||
|
15 2.03783430 0.1704320
|
||
|
16 0.980031800 0.6975960
|
||
|
17 0.445625400 0.3891500
|
||
|
18 0.106417000 0.0218960
|
||
|
19 0.052570500 -0.0082540
|
||
|
S 19
|
||
|
1 794951.6500000 -0.0000010
|
||
|
2 180907.5600000 -0.0000050
|
||
|
3 51241.9330000 -0.0000190
|
||
|
4 16717.4490000 -0.0000710
|
||
|
5 6035.2659000 -0.0002290
|
||
|
6 2353.8571000 -0.0006830
|
||
|
7 976.1464600 -0.0018400
|
||
|
8 425.4356300 -0.0045110
|
||
|
9 193.0467700 -0.0094850
|
||
|
10 90.4393690 -0.0162070
|
||
|
11 43.0207130 -0.0151910
|
||
|
12 19.1905550 0.0138500
|
||
|
13 9.42571640 0.0823580
|
||
|
14 4.60524340 0.1108740
|
||
|
15 2.03783430 -0.0582960
|
||
|
16 0.980031800 -0.2486150
|
||
|
17 0.445625400 -0.2792160
|
||
|
18 0.106417000 0.3433130
|
||
|
19 0.052570500 0.6149170
|
||
|
S 20
|
||
|
1 5309148.1000000 -0.0000110
|
||
|
2 794951.6500000 0.0000870
|
||
|
3 180907.5600000 -0.0000550
|
||
|
4 51241.9330000 -0.0000160
|
||
|
5 16717.4490000 -0.0001330
|
||
|
6 6035.2659000 -0.0003960
|
||
|
7 2353.8571000 -0.0012340
|
||
|
8 976.1464600 -0.0031340
|
||
|
9 425.4356300 -0.0083600
|
||
|
10 193.0467700 -0.0155360
|
||
|
11 90.4393690 -0.0318950
|
||
|
12 43.0207130 -0.0195050
|
||
|
13 19.1905550 0.0050340
|
||
|
14 9.42571640 0.1969510
|
||
|
15 4.60524340 0.1221620
|
||
|
16 2.03783430 0.0483240
|
||
|
17 0.980031800 -1.0031570
|
||
|
18 0.445625400 0.2569670
|
||
|
19 0.106417000 2.0565020
|
||
|
20 0.052570500 -1.1902550
|
||
|
S 20
|
||
|
1 5309148.1000000 0.0000460
|
||
|
2 794951.6500000 -0.0002000
|
||
|
3 180907.5600000 0.0007630
|
||
|
4 51241.9330000 -0.0021410
|
||
|
5 16717.4490000 0.0061820
|
||
|
6 6035.2659000 -0.0056600
|
||
|
7 2353.8571000 0.0007270
|
||
|
8 976.1464600 -0.0065600
|
||
|
9 425.4356300 -0.0125850
|
||
|
10 193.0467700 -0.0249610
|
||
|
11 90.4393690 -0.0528180
|
||
|
12 43.0207130 -0.0271110
|
||
|
13 19.1905550 -0.0050550
|
||
|
14 9.42571640 0.3686510
|
||
|
15 4.60524340 0.1803110
|
||
|
16 2.03783430 -0.0262370
|
||
|
17 0.980031800 -2.3503980
|
||
|
18 0.445625400 2.7374740
|
||
|
19 0.106417000 -0.1498370
|
||
|
20 0.052570500 -2.2160630
|
||
|
S 1
|
||
|
1 0.024356800 1.0000000
|
||
|
P 15
|
||
|
1 7999.8045000 0.0000880
|
||
|
2 1894.4515000 0.0007770
|
||
|
3 615.1874800 0.0044040
|
||
|
4 234.9274100 0.0186640
|
||
|
5 99.2137530 0.0620720
|
||
|
6 44.9161400 0.1590770
|
||
|
7 21.2497170 0.2969700
|
||
|
8 10.3304580 0.3688010
|
||
|
9 5.10497990 0.2348260
|
||
|
10 2.44069040 0.0493560
|
||
|
11 1.15120500 0.0009920
|
||
|
12 0.529555600 0.0008040
|
||
|
13 0.221190000 -0.0002200
|
||
|
14 0.088000000 0.0001060
|
||
|
15 0.035000000 -0.0000520
|
||
|
P 15
|
||
|
1 7999.8045000 -0.0000290
|
||
|
2 1894.4515000 -0.0002610
|
||
|
3 615.1874800 -0.0014820
|
||
|
4 234.9274100 -0.0063570
|
||
|
5 99.2137530 -0.0214770
|
||
|
6 44.9161400 -0.0571340
|
||
|
7 21.2497170 -0.1104660
|
||
|
8 10.3304580 -0.1481470
|
||
|
9 5.10497990 -0.0554260
|
||
|
10 2.44069040 0.2455620
|
||
|
11 1.15120500 0.4757130
|
||
|
12 0.529555600 0.3594260
|
||
|
13 0.221190000 0.0766160
|
||
|
14 0.088000000 -0.0013160
|
||
|
15 0.035000000 0.0021070
|
||
|
P 15
|
||
|
1 7999.8045000 0.0000090
|
||
|
2 1894.4515000 0.0000770
|
||
|
3 615.1874800 0.0004470
|
||
|
4 234.9274100 0.0018750
|
||
|
5 99.2137530 0.0064860
|
||
|
6 44.9161400 0.0168790
|
||
|
7 21.2497170 0.0337830
|
||
|
8 10.3304580 0.0435580
|
||
|
9 5.10497990 0.0187800
|
||
|
10 2.44069040 -0.0920490
|
||
|
11 1.15120500 -0.1600270
|
||
|
12 0.529555600 -0.2082470
|
||
|
13 0.221190000 0.2396000
|
||
|
14 0.088000000 0.7498280
|
||
|
15 0.035000000 0.1726060
|
||
|
P 15
|
||
|
1 7999.8045000 -0.0002750
|
||
|
2 1894.4515000 0.0002760
|
||
|
3 615.1874800 0.0008000
|
||
|
4 234.9274100 0.0038990
|
||
|
5 99.2137530 0.0123110
|
||
|
6 44.9161400 0.0350840
|
||
|
7 21.2497170 0.0626880
|
||
|
8 10.3304580 0.1012360
|
||
|
9 5.10497990 0.0187950
|
||
|
10 2.44069040 -0.1609690
|
||
|
11 1.15120500 -0.6082270
|
||
|
12 0.529555600 0.1116360
|
||
|
13 0.221190000 1.3650390
|
||
|
14 0.088000000 -0.6559960
|
||
|
15 0.035000000 -0.4695280
|
||
|
P 15
|
||
|
1 7999.8045000 -0.0009600
|
||
|
2 1894.4515000 0.0043610
|
||
|
3 615.1874800 -0.0149820
|
||
|
4 234.9274100 0.0144880
|
||
|
5 99.2137530 0.0135750
|
||
|
6 44.9161400 0.0389950
|
||
|
7 21.2497170 0.0925800
|
||
|
8 10.3304580 0.1135110
|
||
|
9 5.10497990 0.1171590
|
||
|
10 2.44069040 -0.4618710
|
||
|
11 1.15120500 -1.1103390
|
||
|
12 0.529555600 2.3649510
|
||
|
13 0.221190000 -1.1476610
|
||
|
14 0.088000000 -0.6841230
|
||
|
15 0.035000000 1.1124400
|
||
|
P 1
|
||
|
1 0.014000000 1.0000000
|
||
|
D 9
|
||
|
1 89.5692010 0.0019660
|
||
|
2 26.5843560 0.0147190
|
||
|
3 9.77103230 0.0582080
|
||
|
4 3.96193290 0.1581680
|
||
|
5 1.68926890 0.2828350
|
||
|
6 0.715670600 0.3453520
|
||
|
7 0.293810600 0.3184370
|
||
|
8 0.110830500 0.1856600
|
||
|
9 0.044000000 0.0376320
|
||
|
D 9
|
||
|
1 89.5692010 -0.0020110
|
||
|
2 26.5843560 -0.0150950
|
||
|
3 9.77103230 -0.0603600
|
||
|
4 3.96193290 -0.1672650
|
||
|
5 1.68926890 -0.2740660
|
||
|
6 0.715670600 -0.2505030
|
||
|
7 0.293810600 0.2022710
|
||
|
8 0.110830500 0.5910090
|
||
|
9 0.044000000 0.2444200
|
||
|
D 9
|
||
|
1 89.5692010 -0.0031930
|
||
|
2 26.5843560 -0.0247180
|
||
|
3 9.77103230 -0.1011760
|
||
|
4 3.96193290 -0.2745010
|
||
|
5 1.68926890 -0.3784140
|
||
|
6 0.715670600 0.1781750
|
||
|
7 0.293810600 0.8056580
|
||
|
8 0.110830500 -0.3375820
|
||
|
9 0.044000000 -0.5026250
|
||
|
D 9
|
||
|
1 89.5692010 0.0198860
|
||
|
2 26.5843560 -0.0474660
|
||
|
3 9.77103230 -0.0966340
|
||
|
4 3.96193290 -0.3628120
|
||
|
5 1.68926890 -0.2782630
|
||
|
6 0.715670600 1.0454190
|
||
|
7 0.293810600 -0.3759280
|
||
|
8 0.110830500 -0.8223810
|
||
|
9 0.044000000 0.9827220
|
||
|
F 6
|
||
|
1 5.43500000 0.0242150
|
||
|
2 2.17400000 0.0981360
|
||
|
3 0.870000000 0.2845860
|
||
|
4 0.348000000 0.4948020
|
||
|
5 0.139000000 0.3486170
|
||
|
6 0.056000000 0.0641200
|
||
|
F 6
|
||
|
1 5.43500000 -0.0748530
|
||
|
2 2.17400000 -0.2964440
|
||
|
3 0.870000000 -0.5568820
|
||
|
4 0.348000000 0.0323020
|
||
|
5 0.139000000 0.5926780
|
||
|
6 0.056000000 0.1487120
|
||
|
F 6
|
||
|
1 5.43500000 -0.1778880
|
||
|
2 2.17400000 -0.5063690
|
||
|
3 0.870000000 -0.1195650
|
||
|
4 0.348000000 0.9269920
|
||
|
5 0.139000000 -0.5184050
|
||
|
6 0.056000000 -0.3772850
|
||
|
G 4
|
||
|
1 2.61000000 0.0931460
|
||
|
2 1.04400000 0.2793720
|
||
|
3 0.417600000 0.5663260
|
||
|
4 0.167000000 0.3445500
|
||
|
G 4
|
||
|
1 2.61000000 -0.3960340
|
||
|
2 1.04400000 -0.5362870
|
||
|
3 0.417600000 0.0624540
|
||
|
4 0.167000000 0.6361110
|
||
|
|
||
|
VANADIUM
|
||
|
S 19
|
||
|
1 3321857.0000000 0.0000090
|
||
|
2 497435.6000000 0.0000690
|
||
|
3 113202.7000000 0.0003610
|
||
|
4 32063.3300000 0.0015220
|
||
|
5 10459.6200000 0.0055120
|
||
|
6 3775.5060000 0.0176680
|
||
|
7 1472.0400000 0.0503830
|
||
|
8 609.9331000 0.1248090
|
||
|
9 265.2634000 0.2517260
|
||
|
10 119.8607000 0.3592260
|
||
|
11 55.4489100 0.2741650
|
||
|
12 24.9837200 0.0648620
|
||
|
13 11.8805600 -0.0011640
|
||
|
14 5.66031100 0.0019800
|
||
|
15 2.49570300 -0.0009180
|
||
|
16 1.17786600 0.0004040
|
||
|
17 0.520044000 -0.0001650
|
||
|
18 0.115965000 0.0000680
|
||
|
19 0.058938000 -0.0000550
|
||
|
S 19
|
||
|
1 3321857.0000000 -0.0000030
|
||
|
2 497435.6000000 -0.0000200
|
||
|
3 113202.7000000 -0.0001080
|
||
|
4 32063.3300000 -0.0004540
|
||
|
5 10459.6200000 -0.0016500
|
||
|
6 3775.5060000 -0.0053400
|
||
|
7 1472.0400000 -0.0155930
|
||
|
8 609.9331000 -0.0407240
|
||
|
9 265.2634000 -0.0920840
|
||
|
10 119.8607000 -0.1663640
|
||
|
11 55.4489100 -0.1858060
|
||
|
12 24.9837200 0.0458580
|
||
|
13 11.8805600 0.5080610
|
||
|
14 5.66031100 0.5069380
|
||
|
15 2.49570300 0.0942810
|
||
|
16 1.17786600 -0.0026620
|
||
|
17 0.520044000 0.0023620
|
||
|
18 0.115965000 -0.0005850
|
||
|
19 0.058938000 0.0004730
|
||
|
S 19
|
||
|
1 3321857.0000000 0.0000010
|
||
|
2 497435.6000000 0.0000070
|
||
|
3 113202.7000000 0.0000400
|
||
|
4 32063.3300000 0.0001650
|
||
|
5 10459.6200000 0.0006020
|
||
|
6 3775.5060000 0.0019490
|
||
|
7 1472.0400000 0.0057030
|
||
|
8 609.9331000 0.0150030
|
||
|
9 265.2634000 0.0343340
|
||
|
10 119.8607000 0.0640090
|
||
|
11 55.4489100 0.0749970
|
||
|
12 24.9837200 -0.0196020
|
||
|
13 11.8805600 -0.2870220
|
||
|
14 5.66031100 -0.4540940
|
||
|
15 2.49570300 0.0910300
|
||
|
16 1.17786600 0.7111500
|
||
|
17 0.520044000 0.4310330
|
||
|
18 0.115965000 0.0260820
|
||
|
19 0.058938000 -0.0114010
|
||
|
S 18
|
||
|
1 497435.6000000 -0.0000020
|
||
|
2 113202.7000000 -0.0000090
|
||
|
3 32063.3300000 -0.0000390
|
||
|
4 10459.6200000 -0.0001420
|
||
|
5 3775.5060000 -0.0004620
|
||
|
6 1472.0400000 -0.0013500
|
||
|
7 609.9331000 -0.0035550
|
||
|
8 265.2634000 -0.0081450
|
||
|
9 119.8607000 -0.0152360
|
||
|
10 55.4489100 -0.0179490
|
||
|
11 24.9837200 0.0046600
|
||
|
12 11.8805600 0.0722260
|
||
|
13 5.66031100 0.1216230
|
||
|
14 2.49570300 -0.0337280
|
||
|
15 1.17786600 -0.2473110
|
||
|
16 0.520044000 -0.2829190
|
||
|
17 0.115965000 0.3308530
|
||
|
18 0.058938000 0.5871420
|
||
|
S 19
|
||
|
1 3321857.0000000 -0.0000190
|
||
|
2 497435.6000000 0.0001450
|
||
|
3 113202.7000000 -0.0000960
|
||
|
4 32063.3300000 -0.0000400
|
||
|
5 10459.6200000 -0.0002700
|
||
|
6 3775.5060000 -0.0008590
|
||
|
7 1472.0400000 -0.0023670
|
||
|
8 609.9331000 -0.0068060
|
||
|
9 265.2634000 -0.0138760
|
||
|
10 119.8607000 -0.0305530
|
||
|
11 55.4489100 -0.0260690
|
||
|
12 24.9837200 -0.0092330
|
||
|
13 11.8805600 0.1779380
|
||
|
14 5.66031100 0.1543150
|
||
|
15 2.49570300 0.0921260
|
||
|
16 1.17786600 -1.0115070
|
||
|
17 0.520044000 0.2281550
|
||
|
18 0.115965000 2.1204380
|
||
|
19 0.058938000 -1.2643960
|
||
|
S 19
|
||
|
1 3321857.0000000 -0.0000440
|
||
|
2 497435.6000000 0.0002350
|
||
|
3 113202.7000000 -0.0007760
|
||
|
4 32063.3300000 0.0031230
|
||
|
5 10459.6200000 -0.0027770
|
||
|
6 3775.5060000 -0.0002450
|
||
|
7 1472.0400000 -0.0044220
|
||
|
8 609.9331000 -0.0108530
|
||
|
9 265.2634000 -0.0222110
|
||
|
10 119.8607000 -0.0513090
|
||
|
11 55.4489100 -0.0383960
|
||
|
12 24.9837200 -0.0274690
|
||
|
13 11.8805600 0.3348540
|
||
|
14 5.66031100 0.2493860
|
||
|
15 2.49570300 0.0638120
|
||
|
16 1.17786600 -2.4167250
|
||
|
17 0.520044000 2.6591510
|
||
|
18 0.115965000 -0.1076490
|
||
|
19 0.058938000 -2.1632850
|
||
|
S 1
|
||
|
1 0.026946000 1.0000000
|
||
|
P 14
|
||
|
1 5777.3770000 0.0001840
|
||
|
2 1368.6740000 0.0016110
|
||
|
3 444.1233000 0.0089330
|
||
|
4 169.0991000 0.0364080
|
||
|
5 71.1019100 0.1125600
|
||
|
6 31.9031100 0.2523880
|
||
|
7 14.8510900 0.3804890
|
||
|
8 7.08522700 0.3104780
|
||
|
9 3.32442200 0.0880800
|
||
|
10 1.54116400 0.0031980
|
||
|
11 0.690520000 0.0013680
|
||
|
12 0.285424000 -0.0003880
|
||
|
13 0.114200000 0.0002150
|
||
|
14 0.045700000 -0.0001030
|
||
|
P 14
|
||
|
1 5777.3770000 -0.0000630
|
||
|
2 1368.6740000 -0.0005500
|
||
|
3 444.1233000 -0.0030750
|
||
|
4 169.0991000 -0.0126800
|
||
|
5 71.1019100 -0.0404390
|
||
|
6 31.9031100 -0.0941680
|
||
|
7 14.8510900 -0.1514260
|
||
|
8 7.08522700 -0.1125800
|
||
|
9 3.32442200 0.1678610
|
||
|
10 1.54116400 0.4695080
|
||
|
11 0.690520000 0.4201240
|
||
|
12 0.285424000 0.1090000
|
||
|
13 0.114200000 -0.0012830
|
||
|
14 0.045700000 0.0029660
|
||
|
P 14
|
||
|
1 5777.3770000 0.0000190
|
||
|
2 1368.6740000 0.0001660
|
||
|
3 444.1233000 0.0009150
|
||
|
4 169.0991000 0.0038240
|
||
|
5 71.1019100 0.0120620
|
||
|
6 31.9031100 0.0286260
|
||
|
7 14.8510900 0.0453740
|
||
|
8 7.08522700 0.0357370
|
||
|
9 3.32442200 -0.0632290
|
||
|
10 1.54116400 -0.1621300
|
||
|
11 0.690520000 -0.2105220
|
||
|
12 0.285424000 0.1306620
|
||
|
13 0.114200000 0.7304420
|
||
|
14 0.045700000 0.2787350
|
||
|
P 14
|
||
|
1 5777.3770000 -0.0005020
|
||
|
2 1368.6740000 0.0005280
|
||
|
3 444.1233000 0.0018630
|
||
|
4 169.0991000 0.0074810
|
||
|
5 71.1019100 0.0254270
|
||
|
6 31.9031100 0.0547060
|
||
|
7 14.8510900 0.1035950
|
||
|
8 7.08522700 0.0621770
|
||
|
9 3.32442200 -0.1166360
|
||
|
10 1.54116400 -0.5464790
|
||
|
11 0.690520000 -0.1494390
|
||
|
12 0.285424000 1.3803190
|
||
|
13 0.114200000 -0.3515930
|
||
|
14 0.045700000 -0.6486200
|
||
|
P 14
|
||
|
1 5777.3770000 -0.0018770
|
||
|
2 1368.6740000 0.0085150
|
||
|
3 444.1233000 -0.0288330
|
||
|
4 169.0991000 0.0326910
|
||
|
5 71.1019100 0.0171180
|
||
|
6 31.9031100 0.0850580
|
||
|
7 14.8510900 0.1176090
|
||
|
8 7.08522700 0.1477620
|
||
|
9 3.32442200 -0.2850060
|
||
|
10 1.54116400 -1.1883840
|
||
|
11 0.690520000 1.8230990
|
||
|
12 0.285424000 -0.2143400
|
||
|
13 0.114200000 -1.4357020
|
||
|
14 0.045700000 1.3682950
|
||
|
P 1
|
||
|
1 0.018300000 1.0000000
|
||
|
D 10
|
||
|
1 155.8527000 0.0008550
|
||
|
2 46.4977100 0.0071660
|
||
|
3 17.6299900 0.0316240
|
||
|
4 7.35467200 0.0958440
|
||
|
5 3.27405100 0.2061640
|
||
|
6 1.48248200 0.3042010
|
||
|
7 0.661351000 0.3253210
|
||
|
8 0.284826000 0.2666120
|
||
|
9 0.112899000 0.1358370
|
||
|
10 0.045160000 0.0212920
|
||
|
D 10
|
||
|
1 155.8527000 -0.0009320
|
||
|
2 46.4977100 -0.0074970
|
||
|
3 17.6299900 -0.0340170
|
||
|
4 7.35467200 -0.1044940
|
||
|
5 3.27405100 -0.2226390
|
||
|
6 1.48248200 -0.2784230
|
||
|
7 0.661351000 -0.1178410
|
||
|
8 0.284826000 0.3542000
|
||
|
9 0.112899000 0.5302290
|
||
|
10 0.045160000 0.1566310
|
||
|
D 10
|
||
|
1 155.8527000 0.0014700
|
||
|
2 46.4977100 0.0116580
|
||
|
3 17.6299900 0.0542500
|
||
|
4 7.35467200 0.1709480
|
||
|
5 3.27405100 0.3434530
|
||
|
6 1.48248200 0.2393790
|
||
|
7 0.661351000 -0.5150960
|
||
|
8 0.284826000 -0.5469710
|
||
|
9 0.112899000 0.5516150
|
||
|
10 0.045160000 0.3451870
|
||
|
D 10
|
||
|
1 155.8527000 -0.0105810
|
||
|
2 46.4977100 0.0191830
|
||
|
3 17.6299900 0.0775000
|
||
|
4 7.35467200 0.2167100
|
||
|
5 3.27405100 0.4686440
|
||
|
6 1.48248200 -0.3055970
|
||
|
7 0.661351000 -0.9422950
|
||
|
8 0.284826000 1.0558660
|
||
|
9 0.112899000 0.0755570
|
||
|
10 0.045160000 -0.6885400
|
||
|
D 10
|
||
|
1 155.8527000 -0.0254710
|
||
|
2 46.4977100 0.1124650
|
||
|
3 17.6299900 -0.1882720
|
||
|
4 7.35467200 -0.2619330
|
||
|
5 3.27405100 -0.5000830
|
||
|
6 1.48248200 1.3735240
|
||
|
7 0.661351000 -0.7524420
|
||
|
8 0.284826000 -0.5906400
|
||
|
9 0.112899000 1.3961510
|
||
|
10 0.045160000 -1.0661100
|
||
|
F 6
|
||
|
1 7.32420000 0.0261020
|
||
|
2 2.92970000 0.1169100
|
||
|
3 1.17190000 0.3217760
|
||
|
4 0.468800000 0.4782430
|
||
|
5 0.187500000 0.3204900
|
||
|
6 0.075000000 0.0645420
|
||
|
F 6
|
||
|
1 7.32420000 -0.0715170
|
||
|
2 2.92970000 -0.2948810
|
||
|
3 1.17190000 -0.5374860
|
||
|
4 0.468800000 0.0630260
|
||
|
5 0.187500000 0.5924440
|
||
|
6 0.075000000 0.1736520
|
||
|
F 6
|
||
|
1 7.32420000 -0.1519690
|
||
|
2 2.92970000 -0.5703090
|
||
|
3 1.17190000 -0.0422130
|
||
|
4 0.468800000 0.8695270
|
||
|
5 0.187500000 -0.4745790
|
||
|
6 0.075000000 -0.3905660
|
||
|
G 4
|
||
|
1 3.51160000 0.1037540
|
||
|
2 1.40630000 0.2939900
|
||
|
3 0.562500000 0.5433640
|
||
|
4 0.225000000 0.3550200
|
||
|
G 4
|
||
|
1 3.51160000 -0.3740200
|
||
|
2 1.40630000 -0.5442250
|
||
|
3 0.562500000 0.0610640
|
||
|
4 0.225000000 0.6522650
|
||
|
|
||
|
|