D0I3WC -OEChem-10121501282D 53 55 0 1 0 0 0 0 0999 V2000 11.7460 2.1479 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.8349 2.7374 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.3800 4.3538 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.0408 3.1034 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.1297 3.6930 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.5960 0.5970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9062 -0.4241 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8169 0.3686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9814 -1.0917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3830 -0.5323 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5208 1.2645 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2511 0.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0065 -1.3142 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7840 -2.2891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2762 -0.1361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 -2.7230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0286 1.0614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4736 -0.8885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2260 0.3090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3830 -0.5323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9820 -2.2891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7595 -1.3142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6536 -2.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7892 -3.7604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4957 1.4870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2295 -3.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5837 -3.9018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 -0.9918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6452 -4.3538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7905 2.4426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2318 -2.7099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.6944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0852 3.3982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2113 -0.7290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4031 -1.5462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6330 1.1993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8906 1.6658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8692 -1.0264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6116 -1.4929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0781 -0.7505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4241 0.9234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1140 0.0263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2090 -2.5871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0991 1.7190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2275 -4.0229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5266 0.8678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1109 1.4100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3744 -3.6121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0973 -4.2491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -0.3858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5965 -4.9718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7789 -3.1334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4082 -1.5094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 2 30 1 0 0 0 0 3 33 1 0 0 0 0 4 33 1 0 0 0 0 5 33 1 0 0 0 0 6 15 2 0 0 0 0 7 19 2 0 0 0 0 8 20 2 0 0 0 0 13 9 1 1 0 0 0 9 15 1 0 0 0 0 9 35 1 0 0 0 0 10 20 1 0 0 0 0 10 22 1 0 0 0 0 10 42 1 0 0 0 0 11 19 1 0 0 0 0 11 25 1 0 0 0 0 11 44 1 0 0 0 0 12 15 1 0 0 0 0 12 17 1 0 0 0 0 12 18 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 13 34 1 0 0 0 0 14 16 1 0 0 0 0 14 23 2 0 0 0 0 16 21 1 0 0 0 0 16 24 2 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 41 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 28 2 0 0 0 0 23 27 1 0 0 0 0 23 43 1 0 0 0 0 24 29 1 0 0 0 0 24 45 1 0 0 0 0 25 30 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 31 1 0 0 0 0 26 48 1 0 0 0 0 27 29 2 0 0 0 0 27 49 1 0 0 0 0 28 32 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 30 33 1 0 0 0 0 31 32 2 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 M END $$$$