B9ETK3 -OEChem-04042105283D 36 38 0 1 0 0 0 0 0999 V2000 -1.8829 0.6721 -1.0344 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8562 -1.1959 1.3198 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0622 2.4671 -1.1043 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1941 -2.4402 -0.5593 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6005 -0.1420 -0.3449 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8373 1.6911 0.8957 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9937 -1.2321 -1.0397 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2474 -0.6019 -0.4380 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7853 1.2745 0.8558 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6286 -1.3478 0.2558 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7406 -0.4724 0.8362 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9086 -0.3445 -0.6818 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1145 0.4108 -0.3427 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7727 -2.0107 1.3363 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3353 0.3266 -0.1344 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7664 1.7210 0.0646 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5073 1.4584 0.6338 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4592 0.7072 0.2902 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8724 0.4565 0.2372 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2883 -1.3977 -1.0457 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3487 0.1392 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6285 -0.8266 -1.6278 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7807 -0.1074 -1.0438 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3611 -2.7199 1.9308 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3643 -1.2746 2.0371 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0679 -2.5632 0.9014 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4383 -2.9731 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7426 -2.0616 -1.3298 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6948 1.5454 0.6165 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0871 2.3218 0.6781 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5399 -1.7876 2.0231 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2586 2.1190 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4761 3.2985 -0.8163 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6814 -2.2692 -1.5947 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 2.0951 1.3795 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7795 1.0797 0.8061 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 11 1 0 0 0 0 2 31 1 0 0 0 0 3 16 1 0 0 0 0 3 33 1 0 0 0 0 4 10 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 5 18 1 0 0 0 0 6 17 1 0 0 0 0 6 18 2 0 0 0 0 7 20 2 0 0 0 0 8 19 2 0 0 0 0 8 20 1 0 0 0 0 9 19 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 12 15 1 0 0 0 0 12 22 1 0 0 0 0 13 16 1 0 0 0 0 13 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 15 17 2 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 20 34 1 0 0 0 0 M END $$$$