21 Twisted DMABN,^1A_1,CC3,cc-pVTZ C 0.00000000 0.00000000 -1.01934887 C 1.20242386 0.00000000 -0.30860536 C -1.20242386 0.00000000 -0.30860536 C 0.00000000 0.00000000 1.77571050 C 1.20827167 0.00000000 1.07821424 C -1.20827167 0.00000000 1.07821424 C 0.00000000 0.00000000 3.20575088 C 0.00000000 1.26574810 -3.11297688 C 0.00000000 -1.26574810 -3.11297688 N 0.00000000 0.00000000 -2.42593161 N 0.00000000 0.00000000 4.36683775 H 2.13140864 0.00000000 -0.85554472 H -2.13140864 0.00000000 -0.85554472 H 2.13684006 0.00000000 1.62436878 H -2.13684006 0.00000000 1.62436878 H 0.00000000 1.08617907 -4.18527979 H 0.00000000 -1.08617907 -4.18527979 H 0.88297409 1.86756840 -2.87668759 H -0.88297409 1.86756840 -2.87668759 H -0.88297409 -1.86756840 -2.87668759 H 0.88297409 -1.86756840 -2.87668759