RDKit 3D 43 47 0 0 0 0 0 0 0 0999 V2000 4.9081 0.3389 1.2248 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6894 0.1736 -0.1591 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4387 0.0225 -0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3302 0.0326 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0253 -0.1127 -0.3525 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8629 -0.2691 -1.7118 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9915 -0.2802 -2.5634 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2551 -0.1356 -2.0633 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3776 -0.1480 -2.9237 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4727 -0.3778 -2.3523 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5563 -0.6444 -1.4150 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3316 -0.3595 0.0146 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4688 -0.3558 0.8268 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2922 -0.1376 2.1888 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0328 0.0673 2.7087 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1121 0.0662 1.9016 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1058 -0.1514 0.5685 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1454 0.3007 2.7798 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7518 0.1881 4.1066 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6564 0.2982 4.0227 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8283 -0.5689 0.3025 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8665 -0.8436 -1.1636 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8457 -0.0880 -1.8255 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9218 1.3220 -1.6078 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9442 0.5573 1.4784 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2005 1.1426 1.5632 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5597 -0.5894 1.7224 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4587 0.1543 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8401 -0.4055 -3.6238 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2744 -0.0362 -2.4828 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3835 -1.2358 -3.0833 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6395 0.5737 -2.9495 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7544 -1.7712 -1.4413 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1789 -0.1343 2.8259 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2047 1.0284 4.6827 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0844 -0.7861 4.5107 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2272 -1.4866 0.8263 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5303 0.2447 0.5952 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8508 -0.5517 -1.5828 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6601 -1.9197 -1.3293 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 1.8235 -2.3115 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9396 1.6509 -1.9003 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6869 1.6510 -0.5867 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 10 1 0 10 11 1 0 11 23 1 0 23 24 1 0 23 22 1 0 22 21 1 0 21 13 1 0 13 12 1 0 12 17 2 0 17 16 1 0 16 18 1 0 18 19 1 0 19 20 1 0 20 15 1 0 15 14 1 0 6 7 1 0 7 8 2 0 8 9 1 0 8 3 1 0 17 5 1 0 15 16 2 0 12 11 1 0 14 13 2 0 1 25 1 0 1 26 1 0 1 27 1 0 4 28 1 0 10 31 1 0 10 32 1 0 11 33 1 1 24 41 1 0 24 42 1 0 24 43 1 0 22 39 1 0 22 40 1 0 21 37 1 0 21 38 1 0 19 35 1 0 19 36 1 0 14 34 1 0 7 29 1 0 9 30 1 0 M END