B8WDF1 -OEChem-04022107053D 42 44 0 1 0 0 0 0 0999 V2000 1.4742 1.0598 1.2639 F 0 0 0 0 0 0 0 0 0 0 0 0 6.1197 1.0899 0.3809 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.7243 -0.2884 -1.4313 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5764 -2.1314 -1.3349 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6691 1.4035 -0.2646 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4194 -1.0306 1.2242 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1235 -1.1087 0.5308 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7429 -1.7313 -1.5815 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 2.3837 -1.3397 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0242 1.9584 0.9215 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3546 3.7005 -0.6706 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4092 3.2658 0.4422 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0485 -0.7647 0.8024 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1859 0.1285 -0.4044 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2608 -2.0457 0.4471 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1651 -3.0162 1.6338 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8623 -1.7258 -0.0698 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0866 -1.1362 -0.4354 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3827 -0.5591 -0.2229 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 0.5333 0.6312 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4946 -1.0943 -0.8733 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7955 1.0908 0.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7569 -0.5371 -0.6694 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9074 0.5553 0.1847 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7037 2.3975 -1.8118 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9707 2.0931 -2.0873 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2574 1.2881 1.3167 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7955 2.1280 1.6803 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2503 4.1609 -0.2363 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9018 4.4151 -1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4105 3.0814 0.0276 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3176 4.0063 1.2412 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5511 -0.2802 1.6429 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7881 -2.5748 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7077 -2.5339 2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5478 -3.8846 1.3762 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1497 -3.3930 1.9268 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8727 -0.1568 1.4907 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4211 -1.6083 2.0632 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4092 -1.9500 -1.5388 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9127 1.9412 1.4998 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6233 -0.9543 -1.1741 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 24 1 0 0 0 0 3 14 2 0 0 0 0 4 8 1 0 0 0 0 4 17 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 5 14 1 0 0 0 0 6 13 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 17 2 0 0 0 0 7 18 1 0 0 0 0 8 18 2 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 33 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 21 23 2 0 0 0 0 21 40 1 0 0 0 0 22 24 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 M END $$$$