B5W4JO -OEChem-04042104333D 31 33 0 0 0 0 0 0 0999 V2000 3.6680 1.5022 -0.0099 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3304 -2.6516 0.0403 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9314 0.3018 -0.0468 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 2.0461 0.0244 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2067 -1.2266 -0.0048 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2918 -0.5082 0.0184 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7203 1.8294 0.0138 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8424 1.1674 -0.0099 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5549 1.0323 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 -0.3398 0.0158 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1199 0.5927 0.0119 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8555 -1.5495 0.0183 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4991 0.2508 0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7146 0.0968 -0.0222 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0795 -0.9986 -0.0021 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5024 -0.9275 -0.0134 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0124 3.4463 0.0057 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1675 -2.3233 -0.0117 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9555 0.3734 -0.0188 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3892 -2.1141 -0.0191 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5222 -1.9276 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7097 3.6600 0.8225 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 3.6901 -0.9442 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 4.1107 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8165 -2.2276 0.8645 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6786 -3.3005 0.0035 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7881 -2.2412 -0.9097 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9795 0.7205 -0.0279 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5421 -2.4683 -1.0437 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3688 -1.8829 0.4125 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9546 -2.9321 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 19 1 0 0 0 0 2 12 2 0 0 0 0 3 14 2 0 0 0 0 4 7 1 0 0 0 0 4 9 1 0 0 0 0 4 17 1 0 0 0 0 5 12 1 0 0 0 0 5 14 1 0 0 0 0 5 18 1 0 0 0 0 6 10 2 0 0 0 0 6 11 1 0 0 0 0 7 11 2 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 10 12 1 0 0 0 0 11 13 1 0 0 0 0 13 15 2 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 17 22 1 0 0 0 0 17 23 1 0 0 0 0 17 24 1 0 0 0 0 18 25 1 0 0 0 0 18 26 1 0 0 0 0 18 27 1 0 0 0 0 19 28 1 0 0 0 0 20 29 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 M END $$$$