LM13GO -OEChem-05032301322D 29 30 0 0 0 0 0 0 0999 V2000 5.6974 1.8649 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7431 0.9650 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9021 2.2521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0064 0.9139 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4374 0.6048 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1974 0.3261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1974 -0.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3884 0.9139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6974 1.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3314 -1.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0634 -1.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3314 -2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0634 -2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2852 2.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1974 -2.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 1.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7945 -0.8639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6004 -0.8639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3084 -0.0016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7945 -2.4839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6004 -2.4839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7868 2.3095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6496 3.1755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7836 3.0384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1974 -3.2939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4149 2.0948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5392 2.0489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5851 1.1733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 9 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 3 16 2 0 0 0 0 4 6 1 0 0 0 0 4 9 2 0 0 0 0 5 8 1 0 0 0 0 5 16 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 9 14 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 11 13 2 0 0 0 0 11 19 1 0 0 0 0 12 15 2 0 0 0 0 12 21 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 15 26 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 M END $$$$