BN1I2G -OEChem-04042107013D 47 49 0 0 0 0 0 0 0999 V2000 -4.1309 0.2247 -0.9385 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8079 -2.8895 -0.0945 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8162 1.4117 -1.7234 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1537 -0.6957 -1.4170 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2437 3.2604 1.7012 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5344 0.7105 0.6495 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4705 1.7094 -0.5995 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7657 -0.1533 0.5448 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9782 1.4845 0.6300 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3137 0.5274 -1.7547 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4605 1.1704 -1.8710 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6643 -0.6897 -0.6906 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -0.7788 -0.5334 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4263 -0.0481 -0.7327 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3215 -2.1511 -0.2921 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0207 -0.0929 -0.5804 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7308 -2.0620 -0.4492 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9311 0.5124 0.3958 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5594 -2.7926 -0.2501 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2465 1.1470 -0.7853 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0321 0.7523 1.2324 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5971 1.5369 1.4234 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3689 2.3928 2.4111 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2289 0.3036 2.6208 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2291 2.4765 -1.5579 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9258 -3.5692 1.1532 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3917 -3.6975 1.5082 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3717 1.0231 -0.9132 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6838 -2.5816 -0.4065 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6278 -3.8621 -0.0708 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1473 0.0950 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0339 2.1901 0.7493 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9003 0.8866 1.9607 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6811 3.0017 3.0059 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9691 1.7730 3.0853 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0611 -0.4053 2.6814 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4515 1.1522 3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3357 -0.1941 3.0122 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4076 3.4695 -1.1378 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6697 2.5636 -2.4921 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1756 1.9606 -1.7378 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4088 -3.0213 1.9509 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4781 -4.5646 1.0601 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9337 -4.2329 0.7217 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8568 -2.7109 1.5991 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5193 -4.2341 2.4525 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7152 3.7939 2.3635 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 6 1 0 0 0 0 1 12 1 0 0 0 0 2 15 1 0 0 0 0 2 26 1 0 0 0 0 5 23 1 0 0 0 0 5 47 1 0 0 0 0 6 22 1 0 0 0 0 6 31 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 7 25 1 0 0 0 0 8 16 2 0 0 0 0 8 18 1 0 0 0 0 9 21 2 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 20 1 0 0 0 0 12 14 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 14 28 1 0 0 0 0 15 19 1 0 0 0 0 17 19 2 0 0 0 0 17 29 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 30 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 32 1 0 0 0 0 22 33 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 M END $$$$