RDKit 3D 45 45 0 0 0 0 0 0 0 0999 V2000 -3.6102 -1.6158 -0.0138 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 -0.6314 0.3835 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1998 -1.3597 0.3526 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2507 -2.8103 0.3503 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2771 -3.4967 0.9219 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -2.9064 1.5769 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2343 -3.4561 2.6879 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -1.8509 1.0239 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1246 -1.6832 -0.2118 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5078 -2.3450 -0.1316 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2387 -0.2534 -0.6561 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4665 0.6892 0.4643 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8419 0.1337 1.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3123 2.0350 0.4138 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2689 2.8220 -0.0454 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4604 3.4058 -1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0869 2.1211 0.0225 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5478 1.9563 -1.2716 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0814 2.8924 0.7972 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3549 2.6539 0.5547 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9071 1.7149 -0.3915 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8497 2.1673 -1.1546 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5504 0.4064 -0.5741 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5453 -1.0066 -0.0499 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3378 -1.9883 -1.0128 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6914 -2.4125 0.7419 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7879 -0.2760 1.4004 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6408 -1.0305 1.2781 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6716 -1.0374 -0.5739 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0804 -3.3214 -0.1169 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3927 -4.5939 0.8779 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6059 -2.2319 -1.0446 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3093 -3.4407 -0.0993 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1184 -2.1401 -1.0084 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9982 -2.0970 0.8393 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1359 -0.1249 -1.3331 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3752 -0.0068 -1.2699 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1797 3.6903 0.6735 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9482 2.7882 -2.1594 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0053 4.4254 -1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5549 3.4432 -1.6096 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0987 1.1962 0.5609 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0268 2.7263 -1.6208 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7147 3.6078 1.5181 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0828 3.2416 1.1433 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 17 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 21 23 1 0 23 2 1 0 1 24 1 0 1 25 1 0 1 26 1 0 2 27 1 1 3 28 1 0 3 29 1 0 4 30 1 0 5 31 1 0 9 32 1 6 10 33 1 0 10 34 1 0 10 35 1 0 11 36 1 0 11 37 1 0 15 38 1 1 16 39 1 0 16 40 1 0 16 41 1 0 17 42 1 1 18 43 1 0 19 44 1 0 20 45 1 0 M END