BP7I8K -OEChem-04022104233D 44 46 0 0 0 0 0 0 0999 V2000 3.7415 1.5033 0.4449 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3707 1.9300 1.6791 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3982 1.6901 -0.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1945 1.7557 -0.5763 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1602 2.1596 0.3544 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7406 1.0044 1.1119 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1453 -2.8078 -0.0868 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2977 -1.3424 1.4425 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0539 -3.5532 -1.2214 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9172 1.6233 -1.1795 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1526 1.8255 -0.6999 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 0.7883 -0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0003 2.8368 -0.9156 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8976 0.7052 0.0966 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 3.0645 -0.6435 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3483 -0.2225 0.6001 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7234 -0.6250 -0.2827 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6107 -1.0697 0.7029 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4474 -1.5750 0.4276 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9646 -1.3255 -1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3121 -2.5601 0.8629 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3797 -0.0239 1.7137 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 -2.6678 -1.1109 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6091 -3.1140 -0.3021 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9696 1.3468 -2.2387 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6554 1.5830 -1.6464 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3187 -0.2164 -0.6709 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1421 0.7516 0.7484 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2282 3.4272 -0.0194 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 3.5186 -1.7604 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7443 2.4324 1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 3.5963 0.3074 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9364 2.9407 -0.8593 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4570 3.6885 -1.4437 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7288 -0.3410 1.4947 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7699 -0.5018 -0.2845 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2353 -0.9117 -0.1856 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2060 -0.7380 1.5625 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3152 -0.9318 -2.0223 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7146 -2.7231 1.7673 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 -3.0989 1.0047 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0478 0.2494 2.5232 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5299 -3.6846 0.2366 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8911 -3.5335 -1.6535 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 5 1 0 0 0 0 1 16 1 0 0 0 0 4 10 1 0 0 0 0 4 14 1 0 0 0 0 4 15 1 0 0 0 0 5 11 1 0 0 0 0 5 31 1 0 0 0 0 6 14 2 0 0 0 0 6 22 1 0 0 0 0 7 19 1 0 0 0 0 7 23 1 0 0 0 0 7 43 1 0 0 0 0 8 19 1 0 0 0 0 8 22 2 0 0 0 0 9 24 3 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 17 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 18 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 18 21 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 20 23 2 0 0 0 0 20 39 1 0 0 0 0 21 24 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 44 1 0 0 0 0 M END $$$$