HT2LIG001048 3D Structure written by MMmdl. 50 53 0 0 1 0 999 V2000 -4.8510 -7.0167 0.6292 C 0 0 0 0 0 0 -3.6801 -6.2259 0.7761 O 0 0 0 0 0 0 -3.7313 -4.9097 0.3709 C 0 0 0 0 0 0 -4.9114 -4.2539 -0.0521 C 0 0 0 0 0 0 -4.8604 -2.9112 -0.4661 C 0 0 0 0 0 0 -3.6365 -2.2173 -0.4709 C 0 0 0 0 0 0 -2.4413 -2.8440 -0.0484 C 0 0 0 0 0 0 -2.5193 -4.1904 0.3809 C 0 0 0 0 0 0 -1.1485 -2.1214 -0.0800 C 0 0 0 0 0 0 -1.0830 -0.7239 0.1008 C 0 0 0 0 0 0 0.1267 0.0058 0.0226 C 0 0 0 0 0 0 0.1467 1.5038 0.1934 C 0 0 0 0 0 0 -0.9264 2.0721 0.4167 O 0 0 0 0 0 0 1.3279 2.1763 0.0688 N 0 0 0 0 0 0 1.2069 3.6610 0.1932 C 0 0 0 0 0 0 2.4877 4.5231 0.3173 C 0 0 0 0 0 0 2.1698 5.9155 0.6293 N 0 0 0 0 0 0 3.3988 6.6156 0.9851 C 0 0 0 0 0 0 1.5562 6.6044 -0.5033 C 0 0 0 0 0 0 2.5006 1.5351 -0.2159 C 0 0 0 0 0 0 3.5733 2.1108 -0.4035 O 0 0 0 0 0 0 2.5034 0.0290 -0.3225 C 0 0 0 0 0 0 3.7036 -0.6865 -0.5505 C 0 0 0 0 0 0 3.7168 -2.0837 -0.6891 C 0 0 0 0 0 0 2.5132 -2.7986 -0.6109 C 0 0 0 0 0 0 1.2946 -2.1309 -0.3819 C 0 0 0 0 0 0 0.0613 -2.8046 -0.3141 C 0 0 0 0 0 0 1.3095 -0.7194 -0.2279 C 0 0 0 0 0 0 -4.6297 -8.0449 0.9152 H 0 0 0 0 0 0 -5.6554 -6.6605 1.2731 H 0 0 0 0 0 0 -5.1950 -7.0313 -0.4059 H 0 0 0 0 0 0 -5.8653 -4.7571 -0.0692 H 0 0 0 0 0 0 -5.7620 -2.4132 -0.7918 H 0 0 0 0 0 0 -3.6247 -1.1953 -0.8199 H 0 0 0 0 0 0 -1.6321 -4.7021 0.7217 H 0 0 0 0 0 0 -1.9942 -0.1798 0.3046 H 0 0 0 0 0 0 0.6259 4.0022 -0.6641 H 0 0 0 0 0 0 0.6067 3.8914 1.0774 H 0 0 0 0 0 0 3.1034 4.1232 1.1255 H 0 0 0 0 0 0 3.0850 4.4866 -0.5966 H 0 0 0 0 0 0 4.1188 6.6075 0.1645 H 0 0 0 0 0 0 3.1908 7.6549 1.2440 H 0 0 0 0 0 0 3.8704 6.1536 1.8535 H 0 0 0 0 0 0 2.1868 6.5573 -1.3930 H 0 0 0 0 0 0 1.3864 7.6554 -0.2652 H 0 0 0 0 0 0 0.5837 6.1795 -0.7506 H 0 0 0 0 0 0 4.6393 -0.1501 -0.6281 H 0 0 0 0 0 0 4.6473 -2.6045 -0.8642 H 0 0 0 0 0 0 2.5274 -3.8728 -0.7283 H 0 0 0 0 0 0 0.0508 -3.8732 -0.4660 H 0 0 0 0 0 0 1 2 1 0 0 0 1 29 1 0 0 0 1 30 1 0 0 0 1 31 1 0 0 0 2 3 1 0 0 0 3 8 1 0 0 0 3 4 2 0 0 0 4 5 1 0 0 0 4 32 1 0 0 0 5 6 2 0 0 0 5 33 1 0 0 0 6 7 1 0 0 0 6 34 1 0 0 0 7 8 2 0 0 0 7 9 1 0 0 0 8 35 1 0 0 0 9 27 1 0 0 0 9 10 2 0 0 0 10 11 1 0 0 0 10 36 1 0 0 0 11 28 2 0 0 0 11 12 1 0 0 0 12 13 2 0 0 0 12 14 1 0 0 0 14 15 1 0 0 0 14 20 1 0 0 0 15 16 1 0 0 0 15 37 1 0 0 0 15 38 1 0 0 0 16 17 1 0 0 0 16 39 1 0 0 0 16 40 1 0 0 0 17 18 1 0 0 0 17 19 1 0 0 0 18 41 1 0 0 0 18 42 1 0 0 0 18 43 1 0 0 0 19 44 1 0 0 0 19 45 1 0 0 0 19 46 1 0 0 0 20 21 2 0 0 0 20 22 1 0 0 0 22 28 1 0 0 0 22 23 2 0 0 0 23 24 1 0 0 0 23 47 1 0 0 0 24 25 2 0 0 0 24 48 1 0 0 0 25 26 1 0 0 0 25 49 1 0 0 0 26 27 2 0 0 0 26 28 1 0 0 0 27 50 1 0 0 0 M END > 364742 > 400Mols.198 $$$$