B87PUD -OEChem-04012117122D 31 32 0 1 0 0 0 0 0999 V2000 4.5411 -1.4139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8198 -3.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6443 -3.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1739 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.6739 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.8261 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9230 -1.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 -2.3649 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2320 -2.3649 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8660 0.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8144 -3.0694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2845 -0.5446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 -0.8769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3566 -1.6660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6197 -2.2679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9506 -2.9173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.3639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0277 -3.1091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.9839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8792 -3.6860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4310 -3.0046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7496 -2.4528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 2.7109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.4839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 1.6370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 11 1 0 0 0 0 11 2 1 1 0 0 0 2 16 1 0 0 0 0 10 3 1 6 0 0 0 3 24 1 0 0 0 0 4 13 2 0 0 0 0 5 15 2 0 0 0 0 8 6 1 6 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 7 13 1 0 0 0 0 7 15 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 22 1 0 0 0 0 12 14 2 0 0 0 0 12 23 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 M END $$$$