BZB7D4 -OEChem-04022112413D 28 27 0 1 0 0 0 0 0999 V2000 -0.3353 0.8377 1.0565 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0398 -1.9267 -0.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3335 -1.3180 1.0541 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9607 0.8444 -0.8422 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2857 -0.1590 -0.1447 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9962 -1.8449 0.0028 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6113 0.4032 -0.4837 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0063 1.3555 0.5494 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5865 1.5653 -0.3163 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0749 1.2913 -0.1698 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7185 -1.0176 0.0376 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5067 -0.5606 -0.0529 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5554 0.5294 0.0163 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0051 0.4023 -1.3969 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9748 2.3855 0.1771 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6192 1.3638 1.4587 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4148 2.6463 -0.3379 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2264 1.1389 -1.2581 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4225 1.7748 0.7511 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5620 1.7539 -1.0358 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3180 0.2675 -1.6031 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9241 1.7973 -1.2026 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4322 1.1509 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5524 0.0802 0.0943 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5668 1.1360 -0.8929 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1142 -2.8320 -0.3366 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9876 -2.0452 0.0798 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3682 -2.6407 -0.0320 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 11 1 0 0 0 0 2 26 1 0 0 0 0 3 11 2 0 0 0 0 4 7 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 10 1 0 0 0 0 5 12 2 0 0 0 0 6 12 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 14 1 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 10 19 1 0 0 0 0 10 20 1 0 0 0 0 12 13 1 0 0 0 0 13 23 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 M END $$$$