Molecule: molecules/M104.xyz
N A X Y Z ESP (i) (ii) (iii) (iv)
-- -- --- --- --- --- ------ ------ ------ ------
1 6 1.2136 0.8646 -0.0281 0.1905 0.3816 0.0194 0.1972 0.1767
2 8 -0.8817 0.6568 -0.0457 -0.5990 -0.5171 -0.6693 -0.5772 -0.5666
3 1 0.0603 -0.5608 0.8351 -0.0152 -0.0360 0.0908 -0.0236 -0.0200
4 1 0.0100 -0.6045 -0.9372 0.0482 -0.0021 0.0908 0.0255 0.0267
5 1 1.2114 1.4220 -0.8161 -0.0152 -0.0359 0.0908 -0.0235 -0.0199
6 1 0.0000 0.0000 0.0000 0.3907 0.2095 0.3775 0.4015 0.4031
------ ------ ------ ------ ------
Sigma: 37.99 32.65 4.84 5.88