10085645 OpenBabel04211813443D 55 57 0 0 0 0 0 0 0 0999 V2000 7.2790 0.4223 -0.2425 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5022 -0.4625 0.4806 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5820 -1.8851 -0.2601 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7958 0.3295 0.0128 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1923 -0.4145 0.3503 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3048 -2.8127 -0.0256 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9005 -2.6337 0.1258 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2245 0.2418 -0.0267 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1310 -1.7820 -0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8040 1.7639 0.5862 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0733 -1.9892 -0.4911 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9763 -0.6439 0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3879 -0.4871 2.0508 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9515 2.5179 -0.1391 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3228 1.8796 0.1646 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5316 -0.7494 1.8562 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 -3.3284 1.4277 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4393 -4.0700 -0.9035 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6834 2.2086 1.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3530 2.5836 -0.6721 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6108 3.8749 -0.4696 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6159 -1.6771 -1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7373 0.4028 -1.0824 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9477 -2.7574 1.2077 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9193 -3.6124 -0.3535 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1239 1.2100 0.4637 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2922 0.3854 -1.1051 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0434 -1.6175 -1.4369 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0482 -2.3323 -0.1529 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8495 2.2530 0.3919 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9885 1.7396 1.6601 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1704 -1.7698 -1.5543 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1679 -2.5719 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9524 -0.8541 1.3743 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0675 -0.1151 0.0178 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3419 0.5343 2.4283 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2588 -0.9903 2.4711 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 -1.0225 2.3415 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7745 2.4837 -1.2141 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9612 3.5553 0.1952 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7350 -1.3596 2.2817 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6214 0.1770 2.4236 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4730 -1.2968 1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1799 -3.9466 1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9553 -2.4792 2.1002 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9364 -3.9204 1.7427 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5725 -4.7133 -0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3447 -4.6109 -0.6281 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4962 -3.7773 -1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6767 3.2888 1.7988 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6748 1.8177 1.8822 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9499 1.7487 2.3153 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8907 2.0367 -1.4466 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0738 4.4230 0.3045 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3588 4.3833 -1.0781 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 2 13 1 1 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 22 1 6 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 23 1 6 0 0 0 5 9 1 0 0 0 0 5 16 1 1 0 0 0 6 11 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 12 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 14 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 19 1 1 0 0 0 15 20 1 0 0 0 0 16 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 17 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 21 2 0 0 0 0 20 53 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 M END