B83NSD -OEChem-04022116493D 39 41 0 0 0 0 0 0 0999 V2000 1.4387 -2.7074 -0.1988 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6863 0.4566 0.2127 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4428 0.7128 0.1702 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3554 1.5531 0.2096 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0465 -1.7460 -0.0187 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0857 -0.6295 0.0477 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2728 -0.6287 0.0096 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6606 0.7107 0.1104 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3347 -3.1393 -0.1556 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0276 -1.6182 -1.2385 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9927 -1.9102 1.2296 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0891 0.7879 0.0754 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4124 -1.4982 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5745 -0.5434 -0.0498 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 1.2270 0.2507 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9436 1.8643 0.1394 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9222 -0.8230 -0.1129 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8374 2.7176 0.3781 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3142 1.5896 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7959 0.2666 -0.0481 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8768 3.3576 -0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0774 -3.9466 -0.1963 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7568 -3.2009 -1.0834 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6951 -3.3506 0.7073 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9992 -2.5231 -1.8587 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0793 -1.4970 -0.9584 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 -0.7944 -1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8681 -2.5306 1.0061 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4419 -2.4338 2.0237 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3195 -0.9936 1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5841 2.8822 0.2344 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2962 -1.8352 -0.2083 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7746 2.9349 0.9051 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0437 3.1376 1.0031 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0265 2.4099 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8688 0.0959 -0.0941 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0248 4.4383 -0.9022 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6958 2.9507 -1.5938 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9461 3.1874 -1.5416 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 15 2 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 4 8 2 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 12 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 25 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 11 30 1 0 0 0 0 12 14 1 0 0 0 0 12 16 2 0 0 0 0 13 14 1 0 0 0 0 14 17 2 0 0 0 0 15 18 1 0 0 0 0 16 19 1 0 0 0 0 16 31 1 0 0 0 0 17 20 1 0 0 0 0 17 32 1 0 0 0 0 18 21 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M END $$$$