BW51IJ -OEChem-04022106423D 69 75 0 0 0 0 0 0 0999 V2000 -4.4602 0.2090 2.5461 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9255 -2.0521 -0.4447 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5921 -0.1494 0.4858 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6638 0.9664 2.1418 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2309 -1.2722 0.2723 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5960 -0.8696 -0.2675 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3388 -0.0214 -0.4582 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2419 -2.1927 0.4121 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2379 -0.8115 -1.1678 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1118 -2.9113 -0.3271 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8374 -2.7703 -1.1078 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8680 0.1966 0.0215 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4358 0.3224 1.8172 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5208 0.8818 1.0443 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5019 -2.1420 -0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4779 -0.0380 -1.1933 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8040 1.3636 0.9087 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -1.9475 -1.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8324 -1.7542 0.4706 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7820 0.4417 -1.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4376 1.1348 -0.3156 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6525 -1.3651 -1.6077 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0731 -1.1716 0.7299 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9831 -0.9771 -0.3092 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2698 -0.3731 -0.0406 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4759 0.9901 -0.1025 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7517 1.4593 0.1748 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4682 -0.8140 0.5407 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7769 0.5619 0.5032 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4253 1.9272 -0.4404 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4870 -1.7050 0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0793 1.0051 0.7894 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2088 2.2817 -1.7721 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 2.4751 0.5654 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0789 0.0920 1.1128 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7819 -1.2646 1.1515 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1964 3.1843 -2.0979 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6165 3.3776 0.2394 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4003 3.7321 -1.0922 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9942 -1.1026 -1.2616 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5795 0.8761 -1.0416 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9495 0.3330 0.5039 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9338 -2.0332 1.4525 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1260 -2.8412 0.4493 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3544 -0.1650 -1.2292 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5517 -1.0273 -2.1978 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4622 -3.2309 -1.3175 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8625 -3.8176 0.2382 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7694 -3.7977 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0211 -2.8581 -2.1868 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8905 1.4158 3.0204 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9916 -0.5677 -2.0029 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3061 1.8958 1.7078 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1678 -2.2453 -2.8832 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1438 -1.9071 1.2973 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3009 0.2792 -2.2962 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4512 1.4953 -0.4723 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3509 -1.2210 -2.4286 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3168 -0.8775 1.7481 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9606 2.5276 0.1381 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3225 2.0650 0.7619 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2800 -2.7730 0.9042 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8201 1.8639 -2.5685 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7839 2.2095 1.6085 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0840 0.4381 1.3334 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5556 -1.9841 1.4029 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0276 3.4600 -3.1347 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9961 3.8038 1.0223 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6116 4.4343 -1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 9 1 0 0 0 0 2 10 1 0 0 0 0 2 11 1 0 0 0 0 3 6 1 0 0 0 0 3 12 1 0 0 0 0 3 13 1 0 0 0 0 4 13 1 0 0 0 0 4 14 1 0 0 0 0 4 51 1 0 0 0 0 5 25 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 40 1 0 0 0 0 7 9 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 10 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 10 47 1 0 0 0 0 10 48 1 0 0 0 0 11 15 1 0 0 0 0 11 49 1 0 0 0 0 11 50 1 0 0 0 0 12 14 1 0 0 0 0 12 16 2 0 0 0 0 14 17 2 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 16 52 1 0 0 0 0 17 21 1 0 0 0 0 17 53 1 0 0 0 0 18 22 1 0 0 0 0 18 54 1 0 0 0 0 19 23 2 0 0 0 0 19 55 1 0 0 0 0 20 21 2 0 0 0 0 20 56 1 0 0 0 0 21 57 1 0 0 0 0 22 24 2 0 0 0 0 22 58 1 0 0 0 0 23 24 1 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 29 1 0 0 0 0 27 60 1 0 0 0 0 28 29 1 0 0 0 0 28 31 2 0 0 0 0 29 32 2 0 0 0 0 30 33 2 0 0 0 0 30 34 1 0 0 0 0 31 36 1 0 0 0 0 31 62 1 0 0 0 0 32 35 1 0 0 0 0 32 61 1 0 0 0 0 33 37 1 0 0 0 0 33 63 1 0 0 0 0 34 38 2 0 0 0 0 34 64 1 0 0 0 0 35 36 2 0 0 0 0 35 65 1 0 0 0 0 36 66 1 0 0 0 0 37 39 2 0 0 0 0 37 67 1 0 0 0 0 38 39 1 0 0 0 0 38 68 1 0 0 0 0 39 69 1 0 0 0 0 M END $$$$