B8TL7V -OEChem-04012114173D 42 45 0 1 0 0 0 0 0999 V2000 -1.6960 1.9015 1.0622 P 0 0 1 0 0 0 0 0 0 0 0 0 -5.3519 -1.0776 -1.1604 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.2893 1.9470 0.7655 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4048 2.3015 -0.3174 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3159 2.7452 2.2486 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2062 0.3463 0.8891 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8712 1.0033 -1.1481 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3279 -1.0763 -1.7479 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6964 0.7406 1.2569 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0831 -1.5794 1.9083 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5661 -3.2980 0.3144 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 2.5694 -0.4456 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0517 -0.6481 0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3326 -0.3324 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8328 1.0907 -0.2326 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6077 2.4347 -1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1271 2.7412 -1.4592 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6276 -1.9865 0.3586 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1434 -1.3600 -0.6524 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8993 0.2965 0.0075 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1864 -1.0011 -0.3849 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4495 -2.9973 -0.1387 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7064 -2.6839 -0.6454 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1305 0.1531 -2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2769 -1.9572 0.6217 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -0.2732 2.1425 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3759 2.0740 -1.3382 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1666 3.6464 -0.5096 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2686 0.0191 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 1.5033 -1.2214 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9194 1.1129 -0.0984 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 2.9139 -0.3739 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1876 2.7970 -2.1349 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 3.8219 -1.5826 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7428 2.2343 -2.3525 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6479 -2.2503 0.7513 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1071 -4.0279 -0.1317 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3455 -3.4686 -1.0392 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1636 0.4705 -3.2094 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6582 -0.0066 3.1831 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6261 -3.9742 1.0635 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7108 -3.5824 -0.6449 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 5 2 0 0 0 0 1 6 1 0 0 0 0 1 12 1 0 0 0 0 2 19 1 0 0 0 0 3 15 1 0 0 0 0 4 12 1 0 0 0 0 4 17 1 0 0 0 0 6 13 1 0 0 0 0 6 29 1 0 0 0 0 7 16 1 0 0 0 0 7 20 1 0 0 0 0 7 24 1 0 0 0 0 8 21 1 0 0 0 0 8 24 2 0 0 0 0 9 20 2 0 0 0 0 9 26 1 0 0 0 0 10 25 1 0 0 0 0 10 26 2 0 0 0 0 11 25 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 22 2 0 0 0 0 18 36 1 0 0 0 0 19 23 2 0 0 0 0 20 21 1 0 0 0 0 21 25 2 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 26 40 1 0 0 0 0 M END $$$$