BMD0R8 -OEChem-04022107343D 54 57 0 0 0 0 0 0 0999 V2000 -2.8789 0.5477 0.1230 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9743 -2.8134 0.3021 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1808 -2.9832 1.2934 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8431 1.1173 -0.0414 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4789 -1.2612 -1.3449 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0684 -2.4002 0.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3623 1.2640 1.3321 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1924 2.4721 -0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3534 2.2476 1.9364 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8962 3.0439 0.7538 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8556 0.4976 -0.9126 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8586 -1.0198 -0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8259 -1.7189 -1.5996 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6287 -1.8452 -0.3984 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2923 -1.2856 -0.2768 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2388 -2.0795 0.1716 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -1.5474 0.2871 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0601 0.0442 -0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2932 -0.2153 -0.0375 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2243 0.5763 -0.4865 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9160 -0.7768 0.4696 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4065 -2.1210 0.8679 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2468 -0.6103 0.4178 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9407 0.6320 0.0492 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2923 1.5534 1.0356 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2470 0.8897 -1.2869 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9503 2.7327 0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9050 2.0690 -1.6367 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2566 2.9904 -0.6502 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3623 0.3190 1.8836 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3518 1.6911 1.3703 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2987 3.0677 -0.6946 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8457 2.4742 -1.3462 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8748 2.8966 2.6768 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1741 1.7177 2.4341 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9811 2.9044 0.6796 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7021 4.1157 0.8634 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8585 0.9264 -0.7549 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 0.6937 -1.9608 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8525 -1.4230 -0.9509 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6472 -1.2682 0.3272 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0373 -1.5311 -2.6577 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8724 -2.8009 -1.4352 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1407 -0.5117 -1.9389 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4136 -3.1230 0.4275 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8528 0.7127 -0.9306 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3761 1.6243 -0.7387 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7837 -3.3434 0.9949 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9288 -1.4276 0.6421 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0609 1.3664 2.0814 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9802 0.1809 -2.0671 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2241 3.4501 1.4539 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1435 2.2697 -2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7688 3.9085 -0.9226 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 21 1 0 0 0 0 2 14 2 0 0 0 0 3 22 2 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 11 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 5 44 1 0 0 0 0 6 17 1 0 0 0 0 6 22 1 0 0 0 0 6 48 1 0 0 0 0 7 9 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 10 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 19 2 0 0 0 0 18 20 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 25 50 1 0 0 0 0 26 28 2 0 0 0 0 26 51 1 0 0 0 0 27 29 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 M END $$$$