BRTL57 -OEChem-04022101363D 56 58 0 0 0 0 0 0 0999 V2000 -4.9634 1.1653 -1.1558 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1473 1.8485 -0.2147 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8946 -0.8782 -0.0412 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7921 2.6893 0.1579 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6472 3.7668 1.0774 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3305 -0.4864 -0.0684 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9222 0.2468 0.3340 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4436 -1.0025 0.4641 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2758 -1.2571 -0.3293 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1284 -1.8380 0.7428 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9424 0.6008 -0.1559 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3437 0.3274 -0.4888 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2457 -0.7748 0.7427 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4021 -2.8534 -0.1313 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6260 1.3138 1.1184 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0160 0.1812 -1.0294 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5778 0.3816 -0.7918 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0442 1.5481 -0.2002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9531 2.6261 0.7507 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6844 -1.1842 0.4616 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6167 -3.8734 0.6807 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2894 -0.6478 -1.1979 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3471 1.6360 -0.0241 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1949 0.5997 -0.4149 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6659 -0.5412 -1.0052 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6306 0.7193 -0.2178 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7219 -0.6818 0.1117 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2525 -1.9530 0.2439 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5908 0.3896 0.1624 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6170 -2.0686 0.4183 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3330 -2.3446 -0.4519 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5578 -0.8103 -1.2901 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8136 -2.3541 1.4266 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4077 -1.3210 1.3827 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9489 -1.1724 1.7205 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1929 0.3177 0.8243 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1317 -3.3901 -0.7501 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7202 -2.3663 -0.8306 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5363 1.5043 1.6979 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9585 0.7234 1.7562 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2939 -0.3406 -1.9411 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3453 -0.8174 1.2531 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7784 -2.2738 0.4162 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0295 -0.7689 -0.4906 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2764 -4.4287 1.3548 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1259 -4.5914 0.0163 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8446 -3.3817 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1028 -1.5477 -1.6681 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7614 2.5375 0.4254 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 -1.3566 -1.3671 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5529 3.7365 1.5334 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 4.6837 0.8649 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7984 -1.3521 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6264 -2.8384 0.2133 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3011 1.4254 0.0726 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0933 -3.0359 0.5279 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 26 2 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 3 12 1 0 0 0 0 4 18 1 0 0 0 0 4 19 2 0 0 0 0 5 19 1 0 0 0 0 5 51 1 0 0 0 0 5 52 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 6 53 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 9 13 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 14 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 16 2 0 0 0 0 13 20 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 21 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 19 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 23 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 25 2 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 50 1 0 0 0 0 27 28 1 0 0 0 0 27 29 2 0 0 0 0 28 30 2 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 M END $$$$