LJ7F2Y -OEChem-05022321313D 42 45 0 1 0 0 0 0 0999 V2000 8.2196 -0.4301 -0.1228 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.4386 1.7530 -1.0192 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0932 3.7264 0.8176 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0417 2.8776 0.4465 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7089 -1.2482 -0.5079 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9175 0.9185 0.5259 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4912 0.3248 0.2510 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3274 -0.4393 -0.7332 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2147 1.0528 -0.8437 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0066 0.2096 0.1944 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5856 -1.0796 -0.2734 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3478 1.9256 -0.4883 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5986 -1.0452 0.2645 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7778 1.3564 0.0713 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6533 -1.2341 -1.1576 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 -1.5269 1.0428 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9882 -1.1531 0.2115 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1674 1.2485 0.0183 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8354 -1.8357 -0.7257 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8819 -2.1286 1.4748 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7727 -0.0063 0.0883 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9497 -2.2829 0.5905 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2140 -0.1183 0.0323 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0557 -1.3194 -0.5442 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2579 0.7807 0.4578 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8890 -0.3263 -0.0716 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8808 0.4863 1.2534 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7933 -0.9941 -1.5037 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6422 1.4093 -1.6962 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0004 -1.9462 0.3674 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3197 2.3406 0.0179 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5738 -0.8941 -2.1869 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8794 -1.4446 1.7493 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1246 3.0825 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4303 -2.1442 0.2792 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7506 2.1601 -0.0868 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6662 -1.9570 -1.4145 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9693 -2.4823 2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8695 -2.7527 0.9265 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3991 3.2780 1.6242 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4605 -2.2274 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8303 1.6126 0.8539 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 12 2 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 4 12 1 0 0 0 0 4 34 1 0 0 0 0 5 23 1 0 0 0 0 5 24 2 0 0 0 0 6 23 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 28 1 0 0 0 0 9 12 1 0 0 0 0 9 29 1 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 13 17 1 0 0 0 0 13 30 1 0 0 0 0 14 18 2 0 0 0 0 14 31 1 0 0 0 0 15 19 1 0 0 0 0 15 32 1 0 0 0 0 16 20 2 0 0 0 0 16 33 1 0 0 0 0 17 21 2 0 0 0 0 17 35 1 0 0 0 0 18 21 1 0 0 0 0 18 36 1 0 0 0 0 19 22 2 0 0 0 0 19 37 1 0 0 0 0 20 22 1 0 0 0 0 20 38 1 0 0 0 0 21 23 1 0 0 0 0 22 39 1 0 0 0 0 24 26 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 M END $$$$