BW4QI1 -OEChem-04022106233D 71 74 0 1 0 0 0 0 0999 V2000 -2.5329 2.3786 0.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1365 -0.6704 2.4355 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1518 -1.5297 -0.7879 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0065 0.2606 -1.5747 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 1.0131 0.1079 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8349 -0.1442 -0.1669 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4702 0.8774 -0.6639 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1583 -0.4654 -0.2431 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5270 -0.6803 -0.9952 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0321 0.3399 0.6878 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.4578 0.5513 -0.7370 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1766 -1.4385 0.3266 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1871 -1.6746 -0.3462 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7009 2.2632 -0.1033 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3969 2.0902 -0.4563 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0993 1.8572 0.3969 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7756 1.8883 -1.0914 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2674 -1.9711 -0.5356 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2378 -0.2966 -1.6547 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3615 -0.3657 0.4617 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.0305 0.5813 0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3070 -0.8424 -2.5235 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7940 -1.9113 0.8917 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7272 -0.7223 1.0728 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5793 0.4306 0.9848 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3349 -1.7402 1.1457 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9757 -0.2010 0.8209 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0756 0.5656 1.5535 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3506 -0.4434 -0.6341 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4026 0.9945 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2445 0.8421 -1.7341 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3823 -0.3739 0.8285 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7669 0.2420 1.7519 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3279 0.4602 -1.4044 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0396 -1.4127 1.4147 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7799 -2.3173 0.0952 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6361 -2.5529 0.1303 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0236 -1.9425 -1.3946 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7398 2.5469 -1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 3.1212 0.4557 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9339 2.9741 -0.9111 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3728 2.4174 1.2977 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8216 2.1055 -0.3883 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4385 2.7147 -0.8056 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6667 1.9482 -2.1813 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1273 -2.1442 -1.1986 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6318 -2.8551 -0.6541 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8068 0.5614 -2.0263 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8526 -1.1911 -1.8052 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3747 -0.4115 -2.3157 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5365 -0.5244 -0.6058 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7437 1.4100 0.7937 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2541 0.7830 1.4404 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7536 -1.7581 -2.7557 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7645 -0.0069 -2.9713 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2674 -0.9122 -3.0485 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3332 -2.8371 1.1277 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9685 -1.8645 1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6257 -0.8595 0.4595 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6226 1.4088 0.4935 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4194 0.6364 2.0523 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0941 3.1681 1.0154 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2756 -2.2810 1.0173 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5943 -2.4078 0.7165 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1433 -1.6516 2.2204 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9535 -1.1859 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7313 0.0926 2.5337 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8519 0.6469 2.6221 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0437 0.0648 1.4444 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1810 1.5771 1.1468 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3997 -1.6708 -1.7264 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 62 1 0 0 0 0 2 24 1 0 0 0 0 2 67 1 0 0 0 0 3 29 1 0 0 0 0 3 71 1 0 0 0 0 4 29 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 5 30 1 0 0 0 0 6 10 1 0 0 0 0 6 12 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 32 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 9 22 1 0 0 0 0 10 16 1 0 0 0 0 10 20 1 0 0 0 0 10 33 1 0 0 0 0 11 17 1 0 0 0 0 11 21 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 16 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 17 1 0 0 0 0 15 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 23 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 25 1 0 0 0 0 20 26 1 0 0 0 0 20 51 1 0 0 0 0 21 24 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 24 59 1 0 0 0 0 25 27 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 26 63 1 0 0 0 0 26 64 1 0 0 0 0 26 65 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 66 1 0 0 0 0 28 68 1 0 0 0 0 28 69 1 0 0 0 0 28 70 1 0 0 0 0 M END $$$$