EXO0631 -OEChem-04222009573D 61 62 0 1 0 0 0 0 0999 V2000 2.5087 0.5234 1.8478 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2576 -2.5346 -0.3722 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5898 -2.2036 1.8052 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 -3.3457 0.0517 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4845 3.1686 -0.8828 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4619 1.3117 -1.7207 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9253 -2.2357 0.3522 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0438 1.5666 0.3697 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8415 0.2362 -0.5067 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0939 -0.5419 -0.0715 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 1.4106 -1.3603 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -0.6520 -1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2147 0.4867 -0.1281 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8822 1.2817 -1.3775 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1347 0.7845 0.7073 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1848 2.1908 1.3502 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9345 -1.4932 -0.3851 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9404 1.2427 1.7744 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 3.5266 0.8387 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 2.4189 0.2265 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0031 1.0708 0.6893 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4387 3.3556 -0.2354 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1297 -2.2454 -1.1924 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7452 -2.4515 0.4783 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5235 2.2129 -0.8976 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2833 -3.1824 -1.1103 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 -3.4642 -0.1882 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0399 -2.4379 1.2097 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0483 -1.0048 0.9183 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3268 -1.3401 -0.7882 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9760 1.3966 -2.3865 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1014 2.3888 -0.9372 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4077 -1.3054 -1.9666 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2269 -0.0255 -1.9127 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1884 1.1343 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2029 0.0213 -0.1839 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 0.7256 -2.2691 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3808 2.2553 -1.3965 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8038 2.3955 2.2329 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3706 -0.8563 0.2971 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7969 1.6809 -0.6081 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 0.2634 2.0621 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4247 1.6527 2.6704 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7999 4.0761 1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4497 4.1467 0.4435 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0929 2.8707 1.0707 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8179 0.4455 1.0744 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5714 0.5236 -0.1578 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9836 2.9748 -1.1588 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8552 4.3387 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2766 -3.1798 -1.5977 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4664 -1.6222 -2.0296 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1181 -2.8197 2.3561 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 -4.1202 -1.5334 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6076 -2.5218 -1.9229 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1287 3.0517 -1.6134 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1288 -4.1097 0.6359 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2563 -3.9618 -0.7442 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3568 -1.4655 1.5961 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7635 -3.0759 2.0547 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8734 -2.8825 0.6575 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 23 1 0 0 0 0 2 26 1 0 0 0 0 3 24 1 0 0 0 0 3 53 1 0 0 0 0 4 24 2 0 0 0 0 5 25 1 0 0 0 0 5 56 1 0 0 0 0 6 25 2 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 15 1 0 0 0 0 10 13 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 14 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 17 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 16 39 1 0 0 0 0 17 23 1 0 0 0 0 17 24 1 0 0 0 0 17 40 1 0 0 0 0 18 21 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 22 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 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 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 M END $$$$