Molecule: molecules/M103.xyz
N A X Y Z ESP (i) (ii) (iii) (iv)
-- -- --- --- --- --- ------ ------ ------ ------
1 6 0.9978 0.9213 -0.0532 0.4750 0.8687 0.4020 0.4504 0.4522
2 8 -1.3397 0.5485 -0.0081 -0.6206 -0.5406 -0.6693 -0.5734 -0.5680
3 8 0.0609 -0.6110 0.8309 -0.6209 -0.5407 -0.6693 -0.5735 -0.5681
4 1 0.0362 -0.6768 -0.9568 0.0616 -0.0461 0.0908 0.0249 0.0157
5 1 1.0544 1.3461 -0.9195 -0.0771 -0.1145 0.0908 -0.0801 -0.0844
6 1 -1.5632 0.9192 -0.8722 0.3909 0.1868 0.3775 0.3759 0.3764
7 1 0.0000 0.0000 0.0000 0.3911 0.1864 0.3775 0.3758 0.3762
------ ------ ------ ------ ------
Sigma: 44.89 17.34 7.25 8.13