mirror of
https://github.com/QuantumPackage/qp2.git
synced 2024-08-30 15:53:42 +02:00
338 lines
11 KiB
Plaintext
338 lines
11 KiB
Plaintext
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HYDROGEN
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S 3
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1 7.0340630 0.0704520
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2 1.0647560 0.4078260
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3 0.2365590 0.6477520
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HELIUM
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S 3
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1 13.6267360 0.0802410
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2 1.9993490 0.4091430
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3 0.3829930 0.6572780
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LITHIUM
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S 3
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1 35.0461500 0.0737600
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2 5.2016900 0.3974710
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3 1.0562400 0.6650920
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S 3
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1 0.8512530 -0.0939700
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2 0.0839510 0.5701000
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3 0.0325540 0.4997500
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BERYLLIUM
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S 3
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1 66.9535400 0.0702000
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2 9.9392900 0.3919100
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3 2.0571300 0.6699700
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S 3
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1 2.3348560 -0.0828200
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2 0.1969760 0.5575530
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3 0.0674490 0.5160430
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BORON
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S 3
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1 108.4370400 0.0686510
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2 16.1205600 0.3899330
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3 3.3734300 0.6713950
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S 3
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1 4.4578540 -0.0824190
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2 0.3693150 0.5590640
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3 0.1225550 0.5167950
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P 3
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1 3.2148920 0.1059000
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2 0.6461360 0.4571800
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3 0.1539160 0.6318610
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CARBON
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S 3
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1 153.1722600 0.0707400
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2 23.0730300 0.3953800
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3 4.9232900 0.6633110
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S 3
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1 6.6166120 -0.0813800
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2 0.5258560 0.5748530
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3 0.1699580 0.5024130
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P 3
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1 4.9129200 0.1099310
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2 0.9976160 0.4627130
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3 0.2326850 0.6275140
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NITROGEN
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S 3
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1 218.3644900 0.0678700
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2 32.5988900 0.3902020
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3 6.9173900 0.6700830
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S 3
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1 8.9194260 -0.0808900
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2 0.7061410 0.5672020
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3 0.2250540 0.5110920
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P 3
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1 6.5562720 0.1159190
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2 1.3490790 0.4699580
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3 0.3122090 0.6184480
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OXYGEN
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S 3
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1 281.8665800 0.0690600
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2 42.4160000 0.3931590
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3 9.0956200 0.6656690
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S 3
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1 11.7893260 -0.0808200
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2 0.9128940 0.5820900
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3 0.2866610 0.4971600
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P 3
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1 8.2741400 0.1242710
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2 1.7154630 0.4765940
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3 0.3830130 0.6130440
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FLUORINE
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S 3
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1 368.3711200 0.0670400
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2 55.0610600 0.3892490
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3 11.7476700 0.6707880
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S 3
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1 15.3647080 -0.0805500
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2 1.1675460 0.5877290
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3 0.3631410 0.4919790
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P 3
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1 10.7256670 0.1262700
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2 2.2258170 0.4779480
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3 0.4861050 0.6140080
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NEON
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S 3
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1 456.9528500 0.0669100
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2 68.3654300 0.3893490
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3 14.6197600 0.6705180
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S 3
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1 19.3271900 -0.0802500
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2 1.4418200 0.5952980
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3 0.4440800 0.4848680
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P 3
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1 13.3525200 0.1288400
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2 2.7794700 0.4804410
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3 0.6009700 0.6116720
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SODIUM
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S 3
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1 542.7605300 0.0684100
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2 81.9594700 0.3920920
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3 17.7237700 0.6660840
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S 3
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1 23.2804200 -0.0838010
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2 1.8683400 0.5827940
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3 0.6232500 0.4924740
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S 3
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1 0.6176110 -0.1157620
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2 0.0652190 0.6958630
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3 0.0253510 0.3810470
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P 3
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1 17.8363600 0.1257100
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2 3.7956900 0.4804610
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3 0.8775100 0.6022810
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MAGNESIUM
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S 3
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1 650.6433670 0.0680300
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2 98.3707800 0.3907380
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3 21.3224900 0.6672670
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S 3
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1 27.9773800 -0.0867200
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2 2.3265200 0.5856970
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3 0.8180800 0.4864970
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S 3
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1 1.0847510 -0.1276510
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2 0.1183140 0.6507730
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3 0.0431240 0.4362720
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P 3
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1 23.2166200 0.1214600
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2 5.0022200 0.4792910
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3 1.2046500 0.5989420
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ALUMINUM
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S 3
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1 777.4433400 0.0668870
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2 117.2315300 0.3877680
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3 25.3762970 0.6707030
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S 3
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1 33.3562530 -0.0889560
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2 2.8013150 0.6010610
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3 1.0227330 0.4687860
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S 3
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1 1.6852460 -0.1513890
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2 0.2049690 0.6593860
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3 0.0747900 0.4386930
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P 3
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1 30.5695800 0.1123530
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2 6.6447010 0.4674670
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3 1.6543950 0.6097820
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P 3
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1 0.0566130 0.3964700
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2 0.3799200 0.2264330
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3 0.1468810 0.5005860
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SILICON
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S 3
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1 909.2348700 0.0664050
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2 137.1245600 0.3862220
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3 29.7148100 0.6722400
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S 3
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1 39.1294230 -0.0909990
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2 3.3359810 0.6116150
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3 1.2512590 0.4568600
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S 3
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1 2.1976490 -0.1687330
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2 0.2759270 0.6754530
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3 0.1004250 0.4294190
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P 3
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1 37.8817610 0.1087530
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2 8.3045980 0.4635150
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3 2.1207920 0.6113340
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P 3
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1 0.5457890 0.2389130
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2 0.0760070 0.3454530
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3 0.2082200 0.5422950
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PHOSPHORUS
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S 3
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1 1053.2658000 0.0658650
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2 158.7904400 0.3845780
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3 34.4244070 0.6739630
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S 3
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1 45.4503770 -0.0926550
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2 3.8999260 0.6265130
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3 1.4885070 0.4410390
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S 3
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1 2.4694830 -0.1805490
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2 0.3208720 0.6809520
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3 0.1168320 0.4291420
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P 3
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1 46.1000190 0.1053880
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2 10.1650570 0.4597120
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3 2.6447940 0.6137140
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P 3
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1 0.6790590 0.2358850
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2 0.2578260 0.5541600
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3 0.0927830 0.3365300
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SULFUR
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S 3
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1 1201.4584000 0.0657650
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2 181.3921200 0.3839480
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3 39.4047950 0.6743720
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S 3
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1 52.1390300 -0.0942320
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2 4.5287990 0.6354680
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3 1.7549380 0.4315060
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S 3
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1 2.9205260 0.1900420
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2 0.3921870 -0.6855270
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3 0.1426990 -0.4292720
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P 3
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1 54.6440710 0.1036730
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2 12.1229020 0.4581900
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3 3.2065040 0.6134000
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P 3
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1 0.8876150 0.2294360
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2 0.1117430 0.3537000
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3 0.3271000 0.5529600
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CHLORINE
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S 3
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1 1362.0220000 0.0655440
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2 205.8111000 0.3829870
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3 44.7721670 0.6752100
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S 3
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1 59.2257320 -0.0956200
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2 5.2139020 0.6414260
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3 2.0473460 0.4251530
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S 3
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1 3.4471240 0.1964010
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2 0.4737850 -0.6923600
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3 0.1713210 -0.4261930
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P 3
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1 64.0999580 0.1017890
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2 14.2871390 0.4561070
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3 3.8281350 0.6142820
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P 3
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1 1.1039040 0.2359030
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2 0.1332360 0.3466000
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3 0.3991780 0.5580660
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ARGON
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S 3
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1 1536.9325000 0.0651590
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2 232.1776500 0.3818070
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3 50.5216850 0.6764460
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S 3
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1 66.9339490 -0.0967400
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2 5.9185520 0.6527490
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3 2.3393420 0.4135730
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S 3
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1 4.0453070 0.2007360
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2 0.5657010 -0.6962680
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3 0.2040650 -0.4248430
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P 3
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1 74.3529150 0.1000790
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2 16.6313460 0.4542260
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3 4.5039270 0.6152590
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P 3
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1 1.3570910 0.2372760
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2 0.4881130 0.5583600
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3 0.1621260 0.3461650
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POTASSIUM
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S 3
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1 1721.1755000 0.0648750
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2 260.0163300 0.3808590
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3 56.6245540 0.6773680
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S 3
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1 75.0556000 -0.0978730
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2 6.6911630 0.6595600
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3 2.6671660 0.4065290
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S 3
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1 4.6689370 -0.2129300
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2 0.7000130 0.6892490
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3 0.2753340 0.4339250
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S 3
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1 0.3227470 -0.1529800
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2 0.0481360 0.6817280
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3 0.0207460 0.4144830
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P 3
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1 85.7898460 0.0980350
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2 19.2547940 0.4510410
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3 5.2686240 0.6177080
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P 3
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1 1.6831450 0.2386360
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2 0.6258090 0.5710570
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3 0.2238980 0.3165360
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CALCIUM
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S 3
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1 1915.4348000 0.0646240
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2 289.5332400 0.3798380
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3 63.1063520 0.6783290
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S 3
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1 83.6332800 -0.0988820
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2 7.5118400 0.6660270
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3 3.0145850 0.3999120
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S 3
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1 5.3707540 -0.2235310
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2 0.8383800 0.7028860
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3 0.3462260 0.4235520
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S 3
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1 0.5068340 -0.1793100
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2 0.0733270 0.6728790
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3 0.0294240 0.4356660
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P 3
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1 97.9745920 0.0963160
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2 22.0673840 0.4481080
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3 6.0938760 0.6199210
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P 3
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1 2.0178860 0.2450290
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2 0.7666510 0.5843850
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3 0.2843190 0.2876660
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