GAS ATOM CHARGE SPIN VOLUME 0 C -5.603659 0.000000 2.283186 1 C -5.836270 0.000000 0.558428 2 C -5.857514 0.000000 0.544882 3 C -5.851382 0.000000 0.653819 4 C -5.888525 0.000000 0.335513 5 C -5.874554 0.000000 0.442724 6 H -0.985962 0.000000 0.204126 7 H -0.971442 0.000000 0.204350 8 C -5.900586 0.000000 0.297815 9 H -0.975278 0.000000 0.203670 10 O -7.865348 0.000000 0.494028 11 O -7.811449 0.000000 0.692267 12 H -0.969071 0.000000 0.117835 13 O -7.852333 0.000000 0.452417 14 H -0.970058 0.000000 0.127889 15 C -5.896245 0.000000 0.334231 16 H -0.980364 0.000000 0.188978 17 H -0.969088 0.000000 0.113919 18 H -0.975960 0.000000 0.083993 TOTAL -78.035088 0.000000 8.334071 0 C -5.592932 0.000000 2.303268 1 C -5.836033 0.000000 0.562652 2 C -5.857037 0.000000 0.549189 3 C -5.851405 0.000000 0.653843 4 C -5.888682 0.000000 0.334623 5 C -5.874713 0.000000 0.442213 6 H -0.985904 0.000000 0.207198 7 H -0.971288 0.000000 0.206269 8 C -5.900731 0.000000 0.297166 9 H -0.975496 0.000000 0.201799 10 O -7.865597 0.000000 0.490402 11 O -7.811097 0.000000 0.698132 12 H -0.969126 0.000000 0.117456 13 O -7.851726 0.000000 0.456042 14 H -0.970510 0.000000 0.123100 15 C -5.896212 0.000000 0.333695 16 H -0.980354 0.000000 0.188771 17 H -0.969174 0.000000 0.112689 18 H -0.976024 0.000000 0.084082 TOTAL -78.024041 0.000000 8.362592