BW9IJ5 -OEChem-04022101353D 61 63 0 0 0 0 0 0 0999 V2000 -5.6251 0.9790 -1.0842 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4156 2.3459 -0.2153 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8476 -2.5456 0.3128 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3807 -1.0918 -0.0477 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5691 2.7792 0.2411 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4906 3.6724 1.2201 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7838 0.0291 -0.1586 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3178 1.0596 0.2303 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7317 -1.5680 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5308 -2.0161 0.6916 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5526 0.5401 -0.1277 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9324 0.1690 -0.4557 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7218 -1.2034 0.7646 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7389 -2.9382 -0.2275 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2760 1.2289 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 0.2272 -1.0261 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 0.5319 -0.7966 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7387 1.7146 -0.1674 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7134 2.6028 0.8435 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1276 -1.7148 0.4837 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8647 -3.9219 0.5372 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -0.4102 -1.2501 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6436 1.9058 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5648 0.9547 -0.4414 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1192 -0.2022 -1.0683 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9893 1.1803 -0.2552 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1885 -0.0622 -0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8224 -1.2972 0.0784 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9743 1.0764 0.0795 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2030 -1.3552 0.2334 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8987 -0.1589 0.3035 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2676 -2.5113 0.4715 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7048 -2.6515 -0.4976 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0609 -1.1102 -1.2754 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1640 -2.6093 1.3628 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8444 -1.4674 1.3427 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3814 -1.6117 1.7236 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7539 -0.1139 0.8865 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4323 -3.5080 -0.8582 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1070 -2.3736 -0.9154 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1905 1.3256 1.7649 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5555 0.6703 1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8564 -0.2813 -1.9537 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5171 -1.2936 -0.4485 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8044 -1.4306 1.2954 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1362 -2.8060 0.3986 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4695 -4.5518 1.1971 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3281 -4.5741 -0.1588 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1256 -3.3929 1.1472 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5737 -1.3205 -1.7495 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9918 2.8203 0.4755 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7956 -0.9523 -1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3848 3.5540 1.6843 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1885 4.6234 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3217 -0.8762 -0.1636 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2470 -2.2179 0.0198 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5917 2.0854 0.0298 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9736 -0.0901 0.4235 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6143 -3.5487 0.5168 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5528 -2.0329 1.4146 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7549 -2.0442 -0.3909 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 26 2 0 0 0 0 3 30 1 0 0 0 0 3 32 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 12 1 0 0 0 0 5 18 1 0 0 0 0 5 19 2 0 0 0 0 6 19 1 0 0 0 0 6 53 1 0 0 0 0 6 54 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 7 55 1 0 0 0 0 8 29 2 0 0 0 0 8 31 1 0 0 0 0 9 13 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 14 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 16 2 0 0 0 0 13 20 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 21 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 19 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 23 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 25 2 0 0 0 0 22 50 1 0 0 0 0 23 24 2 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 52 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 28 56 1 0 0 0 0 29 57 1 0 0 0 0 30 31 2 0 0 0 0 31 58 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 M END $$$$