# atoms were reordered @MOLECULE Molecule Name 12 11 SMALL NO_CHARGES @ATOM 1 C1 0.7981 2.5894 6.3161 C 2 N2 1.4850 1.3136 6.3161 N 3 H3 1.4331 4.7542 6.3161 H 4 H4 2.4846 1.2839 6.3161 H 5 H5 0.1732 2.6662 5.4262 H 6 C6 -0.0886 2.7355 7.5482 C 7 H7 0.9595 0.4627 6.3161 H 8 C8 1.7885 3.7450 6.3161 C 9 H9 0.5242 2.6698 8.4473 H 10 H10 -0.8328 1.9392 7.5574 H 11 H11 -0.5917 3.7020 7.5219 H 12 O12 3.0255 3.5135 6.3161 O @BOND 1 1 2 1 2 1 5 1 3 1 6 1 4 1 8 1 5 2 4 1 6 2 7 1 7 3 8 1 8 6 9 1 9 6 11 1 10 6 10 1 11 8 12 2