BACM85 -OEChem-04022114133D 65 68 0 1 0 0 0 0 0999 V2000 0.3930 0.8433 -3.6094 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1732 -1.4458 -5.0873 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7341 2.4306 -2.7606 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4118 -1.7228 8.0475 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2441 1.9786 -1.6348 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8766 -0.3840 5.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8224 -1.0310 6.2045 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7108 -0.1022 -3.4968 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0547 -0.4992 -4.9413 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8951 0.6477 -2.8764 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1697 -0.7595 -5.8388 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4821 1.2195 -1.5353 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2837 -1.3610 -2.7367 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0375 2.9029 -0.5458 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6872 1.7904 -2.6596 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -1.6533 -7.0172 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 0.5345 -6.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1872 -2.4085 -2.5577 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0094 -1.4600 -2.2231 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0815 2.1863 0.7866 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9572 4.0620 -0.5528 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7977 -3.5550 -1.8651 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 -2.6066 -1.5307 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2654 1.5871 1.2168 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0612 2.1251 1.5842 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4953 -3.6540 -1.3516 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3065 0.9267 2.4447 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 1.4646 2.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1639 0.8656 3.2424 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2074 0.1623 4.5519 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5025 0.1558 5.2598 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5393 -0.4809 6.4278 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3299 -1.1368 6.9685 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0786 -1.6224 6.6331 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7767 0.0077 -2.7605 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1838 1.4859 -3.5251 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 0.2989 -5.4174 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -1.3716 -4.9509 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3306 0.4116 -0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2983 1.8470 -1.1708 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0252 3.3552 -0.7027 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6088 -2.6190 -6.6627 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0008 -1.1817 -7.6355 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6339 -1.8804 -7.6524 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4001 1.0647 -5.6239 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4972 0.3112 -7.1756 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0401 1.2170 -6.7657 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2026 -2.3512 -2.9393 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7489 -0.6756 -2.3432 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0084 3.7770 -0.4638 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7377 4.7699 0.2552 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8725 4.6138 -1.4971 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9323 -1.6071 -5.6733 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5019 -4.3696 -1.7236 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4062 -2.6847 -1.1318 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 1.6190 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0071 2.5638 1.2863 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7985 -4.5464 -0.8121 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2378 0.4436 2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9215 1.4332 3.4183 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3773 0.6690 4.8855 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4481 -0.5211 7.0173 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3935 -2.3586 5.8877 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9760 -2.1160 7.6029 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8318 -0.8328 6.7106 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 15 1 0 0 0 0 2 11 1 0 0 0 0 2 53 1 0 0 0 0 3 15 2 0 0 0 0 4 33 2 0 0 0 0 5 12 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 30 2 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 9 11 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 12 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 16 1 0 0 0 0 11 17 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 18 2 0 0 0 0 13 19 1 0 0 0 0 14 20 1 0 0 0 0 14 21 1 0 0 0 0 14 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 22 1 0 0 0 0 18 48 1 0 0 0 0 19 23 2 0 0 0 0 19 49 1 0 0 0 0 20 24 2 0 0 0 0 20 25 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 26 2 0 0 0 0 22 54 1 0 0 0 0 23 26 1 0 0 0 0 23 55 1 0 0 0 0 24 27 1 0 0 0 0 24 56 1 0 0 0 0 25 28 2 0 0 0 0 25 57 1 0 0 0 0 26 58 1 0 0 0 0 27 29 2 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 60 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 61 1 0 0 0 0 32 33 1 0 0 0 0 32 62 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 M END $$$$