B8JIU1 -OEChem-04012113533D 38 38 0 0 0 0 0 0 0999 V2000 1.9504 1.2437 0.9674 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1796 0.3175 1.1027 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9793 -2.2496 0.9237 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9402 0.1031 -0.8447 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8066 -0.3293 -0.5506 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1228 -1.6911 -0.0347 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0084 0.7593 -0.7354 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6834 0.9889 -0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1295 1.6123 -0.1333 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4641 0.1809 -0.6059 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 1.4536 -0.8777 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8144 0.4392 0.0516 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1832 -0.3700 -0.2247 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7822 -0.3690 0.1616 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0450 -1.2011 -0.9405 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6785 0.4213 0.8119 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4019 -1.2411 -0.6196 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0354 0.3813 1.1325 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8970 -0.4499 0.4166 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8871 1.0101 -1.7962 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2691 -0.3040 -0.6803 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4308 2.0562 -0.0315 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7971 0.7249 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2647 1.3409 0.9211 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8378 2.6691 -0.1584 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5592 0.4203 -1.6723 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2427 -0.8902 -0.5227 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2022 2.1196 -0.4393 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3318 1.7314 -1.9304 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6595 -0.5362 -1.5821 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5269 -0.9403 -1.3151 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6722 -1.8227 -1.7506 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0750 1.0871 1.4123 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0729 -1.8883 -1.1768 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4224 0.9965 1.9397 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9535 -0.4810 0.6665 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6738 -2.3263 -0.6837 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8354 -2.1326 0.4779 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 14 2 0 0 0 0 3 6 1 0 0 0 0 3 38 1 0 0 0 0 4 11 1 0 0 0 0 4 14 1 0 0 0 0 4 30 1 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 5 31 1 0 0 0 0 6 14 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 12 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 15 17 1 0 0 0 0 15 32 1 0 0 0 0 16 18 2 0 0 0 0 16 33 1 0 0 0 0 17 19 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 M END $$$$