B1XHI9 -OEChem-04042104323D 39 41 0 1 0 0 0 0 0999 V2000 -5.8929 -0.6116 0.4396 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8025 -0.3515 -0.5504 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9301 2.8858 0.0267 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0160 -1.1796 -0.3630 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 -0.2124 0.6641 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6504 -1.5905 1.2265 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5089 -2.2144 0.4281 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2535 -1.3492 0.5205 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8144 0.6545 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5216 0.1202 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5539 0.9817 0.0789 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9517 2.0335 0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9246 0.5205 -0.0149 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2988 2.3362 -0.0599 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1725 -0.5394 -0.5525 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7148 0.4458 1.1322 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4546 0.1544 -1.2521 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7306 -0.6277 -1.9477 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0349 0.0048 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7749 -0.2866 -1.3422 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5650 -0.3615 -0.1951 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9175 -0.8129 -0.2878 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6624 0.2786 1.4122 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5167 -2.2626 1.2211 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3353 -1.4860 2.2732 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8075 -2.3291 -0.6214 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2899 -3.2192 0.8071 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4572 -1.7271 -0.2227 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1946 -1.4821 1.5135 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3087 -0.3408 -1.4389 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9271 2.5075 0.3281 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0953 3.0513 -0.2466 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3169 0.7274 2.1044 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 0.2066 -2.1558 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1929 -1.3888 -2.5204 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7883 -0.9021 -1.9053 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6311 0.3413 -2.4445 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6384 -0.0481 1.9451 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1739 -0.5686 -2.3136 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 5 1 0 0 0 0 2 15 1 0 0 0 0 2 30 1 0 0 0 0 3 12 2 0 0 0 0 3 14 1 0 0 0 0 4 22 3 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 11 13 1 0 0 0 0 11 14 2 0 0 0 0 12 31 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 32 1 0 0 0 0 15 18 1 0 0 0 0 16 19 1 0 0 0 0 16 33 1 0 0 0 0 17 20 2 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 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 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 M END $$$$