BB1XC3 -OEChem-04022112143D 41 43 0 1 0 0 0 0 0999 V2000 3.8300 0.9059 0.2404 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0201 2.0007 2.0781 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5122 -1.2460 0.0809 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5883 -3.2221 0.4531 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7576 -1.3284 -0.1754 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8111 0.0631 -0.6442 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2823 0.3055 -0.9397 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4863 1.0821 0.4376 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8777 -1.0817 -1.1428 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0736 -1.9458 -0.1831 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8333 1.3871 1.0379 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8754 2.3546 -0.1306 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6073 -2.0318 0.1477 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4997 2.1065 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8593 2.3486 -1.9386 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7517 -1.8912 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8668 -0.8944 0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2463 -0.1352 1.3788 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5238 -0.7271 -0.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2829 0.7915 1.2666 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5604 0.1994 -1.0593 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9399 0.9587 0.0477 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1842 0.1181 -1.5394 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4613 0.9769 -1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8525 0.6558 1.2236 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9489 -1.1329 -0.9284 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7006 -1.4127 -2.1728 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0223 -2.9941 -0.4908 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 -1.8937 0.8365 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5298 2.7889 -0.8976 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7974 3.1110 0.6607 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2494 1.7405 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7130 -2.2935 1.4129 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9168 -2.7288 -0.2961 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8767 2.1636 -2.2652 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1518 2.7301 -2.6662 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7399 -0.2543 2.3329 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 -1.3105 -1.8172 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5776 1.3836 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0710 0.3308 -2.0088 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7464 1.6808 -0.0399 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 11 1 0 0 0 0 2 11 2 0 0 0 0 3 13 1 0 0 0 0 3 16 1 0 0 0 0 4 13 2 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 12 14 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 37 1 0 0 0 0 19 21 2 0 0 0 0 19 38 1 0 0 0 0 20 22 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 M END $$$$