B7MJ1A -OEChem-04022101353D 39 42 0 0 0 0 0 0 0999 V2000 5.6922 -1.1090 -0.8009 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0241 3.2351 0.5366 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3198 1.0590 -0.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6067 0.4759 0.1699 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4778 -0.5271 -0.2601 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7653 -1.1094 0.0398 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0751 1.8651 0.4794 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2445 0.1711 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6422 -1.4056 0.1973 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9986 -1.8140 -0.5391 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6427 -2.1013 -0.3883 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9149 -0.2369 -0.4234 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5469 2.1231 0.3033 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5922 -0.4027 0.0054 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9490 -0.6889 0.1572 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0486 -2.6949 0.5411 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9353 0.3507 -0.0417 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3556 -1.9782 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4054 -2.9812 0.6929 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6125 1.6797 0.2328 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2086 0.0243 -0.5082 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5633 2.6823 0.0412 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1593 1.0269 -0.7001 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8366 2.3558 -0.4253 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5449 2.5712 -0.1708 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 2.0974 1.5231 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5909 0.9593 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6645 -2.6020 -0.8808 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3131 -3.1041 -0.6459 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2809 0.5823 -0.3312 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3117 1.2494 -0.2428 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3441 -3.4997 0.7323 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3977 -2.2403 0.6619 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7211 -3.9816 0.9745 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6455 1.9784 0.6282 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4957 -0.9917 -0.7648 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3149 3.7165 0.2616 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1489 0.7742 -1.0697 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5769 3.1364 -0.5745 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 13 2 0 0 0 0 3 12 1 0 0 0 0 3 13 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 5 10 1 0 0 0 0 5 12 1 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 6 11 1 0 0 0 0 7 13 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 27 1 0 0 0 0 9 14 1 0 0 0 0 9 16 2 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 16 19 1 0 0 0 0 16 32 1 0 0 0 0 17 20 2 0 0 0 0 17 21 1 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 20 22 1 0 0 0 0 20 35 1 0 0 0 0 21 23 2 0 0 0 0 21 36 1 0 0 0 0 22 24 2 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 M END $$$$