B9M8QR -OEChem-04022118203D 59 62 0 1 0 0 0 0 0999 V2000 3.0530 -0.6868 0.7455 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 0.4369 -2.4581 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6327 6.1882 0.4074 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2338 4.9539 1.4421 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3954 1.2248 -0.3449 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5937 -0.4548 -0.8597 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8427 -1.6422 -0.1971 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8158 1.3657 -0.5756 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3925 2.5475 0.2241 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5408 0.0685 -0.2764 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6839 3.8685 -0.0906 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7004 -2.7902 1.7297 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9195 -1.7363 0.7312 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0575 -4.0886 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5268 0.7656 -1.3217 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9063 0.7031 -0.9356 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7297 -3.8446 0.5012 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2832 5.0257 0.6758 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8969 0.8129 -1.9116 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2615 0.5348 0.4027 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5976 0.5857 -0.2108 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2425 0.7542 -1.5492 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6071 0.4760 0.7651 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5495 -3.9006 1.2426 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6830 -3.5632 -0.8641 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9933 0.5251 0.1654 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6775 -3.6751 0.6185 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4561 -3.3377 -1.4882 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7243 -3.3937 -0.7469 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6781 1.6949 0.4943 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6540 -0.7028 0.1992 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0238 1.6368 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9996 -0.7610 0.5618 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6846 0.4088 0.8908 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9635 1.5721 -1.6437 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3116 2.3431 1.3006 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4657 2.6433 0.0126 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7694 4.0887 -1.1603 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6244 3.8093 0.1799 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0535 1.4834 0.5742 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6627 -3.0511 2.1866 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0717 -2.4014 2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7436 -4.5629 0.4619 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9315 -4.8081 1.9948 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6404 0.9487 -2.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5249 0.4084 1.1904 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0022 0.8424 -2.3223 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8669 0.3360 1.8118 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5735 -4.1162 2.3074 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5938 -3.5193 -1.4553 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5965 -3.7161 1.1959 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4197 -3.1165 -2.5508 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6794 -3.2149 -1.2321 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1782 2.6604 0.4731 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1349 -1.6242 -0.0541 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0177 6.9443 0.8998 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5572 2.5475 1.1131 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5142 -1.7171 0.5882 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7323 0.3634 1.1732 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 13 1 0 0 0 0 2 15 2 0 0 0 0 3 18 1 0 0 0 0 3 56 1 0 0 0 0 4 18 2 0 0 0 0 5 8 1 0 0 0 0 5 15 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 13 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 35 1 0 0 0 0 9 11 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 11 18 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 14 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 14 17 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 17 24 2 0 0 0 0 17 25 1 0 0 0 0 19 22 1 0 0 0 0 19 45 1 0 0 0 0 20 23 2 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 24 27 1 0 0 0 0 24 49 1 0 0 0 0 25 28 2 0 0 0 0 25 50 1 0 0 0 0 26 30 2 0 0 0 0 26 31 1 0 0 0 0 27 29 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 30 32 1 0 0 0 0 30 54 1 0 0 0 0 31 33 2 0 0 0 0 31 55 1 0 0 0 0 32 34 2 0 0 0 0 32 57 1 0 0 0 0 33 34 1 0 0 0 0 33 58 1 0 0 0 0 34 59 1 0 0 0 0 M END $$$$