RDKit 3D 51 55 0 0 0 0 0 0 0 0999 V2000 -4.3728 1.5175 -1.2758 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3725 1.0997 -0.1848 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1765 0.8748 1.0631 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5364 2.2958 -0.0546 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2235 2.0498 0.3969 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5397 2.7262 1.3425 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7743 2.3516 1.7115 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3377 3.1271 2.6673 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3604 1.2636 1.0864 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 0.7855 1.5024 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 1.0506 2.7108 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5521 0.0418 0.6513 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6549 0.2174 -0.7098 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5044 -0.5495 -1.4858 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2868 -1.5252 -0.9205 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1946 -1.7107 0.4413 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3503 -0.9500 1.2159 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6778 0.5490 0.1122 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 0.9651 -0.2041 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3716 0.4049 -1.3616 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7280 -0.7899 -1.9948 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -1.4911 -0.8406 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5445 -2.7760 -1.3641 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8562 -1.5818 0.3623 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2651 -1.1480 0.3288 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6507 -0.0988 -0.6759 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1314 -0.5912 -0.5793 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6557 0.6305 -1.8929 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9603 2.2663 -1.9501 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3086 1.9006 -0.8339 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1611 1.4341 1.0221 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4796 -0.1791 1.2065 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6624 1.3203 1.9507 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0294 3.5748 1.8191 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 3.0471 3.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0759 1.0047 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5334 -0.3544 -2.5687 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9510 -2.1278 -1.5196 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7970 -2.4771 0.9489 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2711 -1.0914 2.2938 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 1.1712 -2.0908 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5232 -1.4310 -2.4258 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0256 -0.4785 -2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3498 -3.1803 -0.7302 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0058 -2.5580 -2.3578 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2854 -3.4891 -1.5305 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8366 -2.6550 0.7293 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3603 -1.0416 1.2324 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9243 -2.0611 0.2242 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5524 -0.7430 1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2445 -0.5905 -1.4648 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 7 9 2 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 9 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 6 22 24 1 0 24 25 1 0 25 26 1 0 22 27 1 0 26 2 1 0 19 5 1 0 26 20 1 0 17 12 1 0 27 18 1 0 1 28 1 0 1 29 1 0 1 30 1 0 3 31 1 0 3 32 1 0 3 33 1 0 6 34 1 0 8 35 1 0 13 36 1 0 14 37 1 0 15 38 1 0 16 39 1 0 17 40 1 0 20 41 1 6 21 42 1 0 21 43 1 0 23 44 1 0 23 45 1 0 23 46 1 0 24 47 1 0 24 48 1 0 25 49 1 0 25 50 1 0 26 51 1 6 M END