BP9JY6 -OEChem-04042101573D 50 52 0 1 0 0 0 0 0999 V2000 -1.9971 1.2272 0.3968 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2072 1.7247 -0.2894 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2063 -0.9237 0.1784 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6027 1.0053 -2.4401 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8405 1.0952 0.0597 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1569 -1.8264 2.5343 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5727 -3.4969 -0.4361 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8575 -1.7471 -1.4203 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5458 -1.5567 -0.3179 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3965 -2.6805 1.1463 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 1.7157 0.5464 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2716 2.6877 -0.7700 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1083 2.0368 -0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6747 2.9518 1.4444 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2694 3.9108 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7069 3.5908 1.5345 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1215 -0.1161 0.2194 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7996 0.9490 -1.2361 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5498 -0.4960 0.0767 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7466 -0.0077 -0.6097 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9010 -1.8321 -0.1151 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8724 -0.4370 -1.3124 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5407 0.4840 0.1355 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5106 -0.4766 0.6828 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8827 0.1279 0.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4002 -1.3746 1.2723 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2431 -2.1884 -0.2481 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7622 -1.3350 -0.7227 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2339 -1.2083 -0.1895 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5259 -1.8038 0.5695 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0362 0.9616 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5639 3.0346 -1.7694 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 2.7049 -1.3657 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0692 1.1166 -1.4364 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0299 2.6794 2.4455 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3996 3.6820 1.0616 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 4.7085 -0.3065 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2913 4.2903 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 2.9136 2.0625 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6496 4.5099 2.1285 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1333 -2.6008 -0.1619 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0598 -0.0704 -2.3189 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2978 1.5329 0.2837 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6302 -0.1604 1.2373 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4142 1.9585 0.1968 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3355 -1.4230 2.8638 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7596 -4.0305 -0.4502 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8564 -1.3202 -2.2943 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0857 -0.7500 -0.2513 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0720 -2.8931 2.0386 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 17 1 0 0 0 0 2 12 1 0 0 0 0 2 18 1 0 0 0 0 3 17 2 0 0 0 0 4 18 2 0 0 0 0 5 25 1 0 0 0 0 5 45 1 0 0 0 0 6 26 1 0 0 0 0 6 46 1 0 0 0 0 7 27 1 0 0 0 0 7 47 1 0 0 0 0 8 28 1 0 0 0 0 8 48 1 0 0 0 0 9 29 1 0 0 0 0 9 49 1 0 0 0 0 10 30 1 0 0 0 0 10 50 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 16 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 2 0 0 0 0 19 23 1 0 0 0 0 20 22 2 0 0 0 0 20 24 1 0 0 0 0 21 27 1 0 0 0 0 21 41 1 0 0 0 0 22 28 1 0 0 0 0 22 42 1 0 0 0 0 23 25 2 0 0 0 0 23 43 1 0 0 0 0 24 26 2 0 0 0 0 24 44 1 0 0 0 0 25 29 1 0 0 0 0 26 30 1 0 0 0 0 27 29 2 0 0 0 0 28 30 2 0 0 0 0 M END $$$$