RDKit 3D 40 42 0 0 0 0 0 0 0 0999 V2000 1.0174 3.5970 2.3237 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6767 2.1728 2.6424 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0489 1.5820 3.6446 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1054 1.6501 1.6574 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5458 0.2893 1.8356 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3152 -0.6288 0.9985 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 -0.5529 0.5158 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5949 0.4964 0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7979 -1.8495 -0.1443 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8378 -2.1565 -0.7045 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7043 -2.6673 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2311 -1.8848 0.6104 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5014 -2.2484 0.8016 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4859 -1.3366 1.3673 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6819 -1.8269 1.7323 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7474 -0.9576 2.2699 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8412 -1.4475 2.5404 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4749 0.5157 2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9789 0.8148 2.6094 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8285 2.3276 2.8068 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0906 0.1614 1.4796 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3678 0.8222 0.1026 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5565 3.6483 1.3748 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 3.9998 3.1109 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1041 4.1954 2.2793 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4337 -0.0266 2.8825 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4479 0.2601 -0.0651 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2011 1.4577 0.2374 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9744 0.6038 1.5994 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8190 -3.2429 0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9484 -2.8749 1.6408 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8797 1.0288 1.5332 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0321 0.8655 3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6853 0.3464 3.5614 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5471 2.6904 3.5513 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0095 2.8872 1.8852 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8438 2.5892 3.1923 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4168 0.7208 -0.1955 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 1.8897 0.1031 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7710 0.3655 -0.6953 H 0 0 0 0 0 0 0 0 0 0 0 0 14 21 1 0 16 18 1 0 6 7 2 0 7 9 1 0 9 11 1 0 11 12 1 0 16 15 1 0 9 10 2 0 18 19 1 0 7 8 1 0 14 13 1 0 19 20 1 0 21 5 1 0 21 22 1 6 5 6 1 0 5 4 1 0 12 13 2 0 16 17 2 0 12 6 1 0 4 2 1 0 19 21 1 0 2 1 1 0 14 15 2 0 2 3 2 0 18 32 1 0 18 33 1 0 19 34 1 1 15 31 1 0 5 26 1 1 13 30 1 0 8 27 1 0 8 28 1 0 8 29 1 0 20 35 1 0 20 36 1 0 20 37 1 0 22 38 1 0 22 39 1 0 22 40 1 0 1 23 1 0 1 24 1 0 1 25 1 0 M END