B6GE3I -OEChem-04022102033D 53 57 0 1 0 0 0 0 0999 V2000 2.9223 1.2970 1.1008 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0768 2.8408 0.8193 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5535 1.3617 -0.8831 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9888 -0.2664 -1.6648 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1106 -0.1985 -2.6299 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1926 0.9914 0.4213 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9328 1.0704 -0.3179 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3511 1.3525 -0.7923 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2769 1.4440 1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8894 1.9481 -0.9836 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5896 -0.4746 0.4163 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7755 -0.8734 -0.2003 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7688 -1.4219 1.0281 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 1.9071 0.0628 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1946 0.2856 -1.7237 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6596 1.2740 0.1171 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1405 -2.2196 -0.2051 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1337 -2.7682 1.0234 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9318 0.2147 -0.7491 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3196 -3.1671 0.4068 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6278 1.7294 1.0198 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1943 -0.3886 -0.7011 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1641 0.0605 0.1965 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8807 1.1193 1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4638 -0.5742 0.2346 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5904 -1.9238 -0.0944 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5898 0.1632 0.6003 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8433 -2.5360 -0.0578 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8427 -0.4490 0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9694 -1.7986 0.3078 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1174 1.5809 0.4549 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7086 0.0081 -0.4636 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4704 2.4238 -1.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6026 0.8066 -1.7072 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4169 0.9110 2.5002 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4236 2.5123 1.7537 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1181 2.0900 -2.0457 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8902 2.9442 -0.5261 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4221 -0.1451 -0.6823 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8357 -1.1546 1.5132 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0635 -2.5304 -0.6858 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4941 -3.5064 1.4984 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6036 -4.2153 0.4025 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4226 2.5492 1.7026 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3950 -1.1919 -1.4069 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8636 -0.9710 -3.2397 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0511 0.1631 -2.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5922 1.4831 1.7922 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7386 -2.5463 -0.3541 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5451 1.2232 0.8348 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9416 -3.5886 -0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7210 0.1262 0.9152 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9449 -2.2752 0.3364 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 9 1 0 0 0 0 2 14 2 0 0 0 0 3 10 1 0 0 0 0 3 14 1 0 0 0 0 3 15 1 0 0 0 0 4 15 2 0 0 0 0 4 19 1 0 0 0 0 5 15 1 0 0 0 0 5 46 1 0 0 0 0 5 47 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 11 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 17 1 0 0 0 0 12 39 1 0 0 0 0 13 18 2 0 0 0 0 13 40 1 0 0 0 0 14 16 1 0 0 0 0 16 19 2 0 0 0 0 16 21 1 0 0 0 0 17 20 2 0 0 0 0 17 41 1 0 0 0 0 18 20 1 0 0 0 0 18 42 1 0 0 0 0 19 22 1 0 0 0 0 20 43 1 0 0 0 0 21 24 2 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 26 49 1 0 0 0 0 27 29 2 0 0 0 0 27 50 1 0 0 0 0 28 30 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 M END $$$$