RDKit 3D 57 60 0 0 0 0 0 0 0 0999 V2000 9.1040 2.0399 0.7888 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3080 1.0936 0.1042 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9507 0.9952 0.2426 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2442 1.8251 1.0737 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8778 1.6619 1.1576 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1832 0.7031 0.4458 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 0.5421 0.5449 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0877 0.5450 1.7627 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 0.4032 1.8873 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0166 0.2474 0.8342 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 0.0964 0.9339 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1833 -0.0677 -0.1484 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5433 -0.2200 -0.0886 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3850 -0.2511 1.0027 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.0980 -1.4085 1.1861 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8351 -1.7288 0.0773 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1000 -2.6444 -0.8795 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8082 -3.8214 -0.1579 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3401 -0.4882 -0.6014 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.4825 -0.7456 -1.3698 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6441 0.5385 0.4812 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.3542 1.6128 0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2806 0.9782 1.0247 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.5008 1.3148 2.3559 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5523 -0.0749 -1.3971 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2014 0.0700 -1.5555 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5813 0.2321 -0.4222 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9574 0.3803 -0.5811 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 0.3722 -1.7062 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9068 -0.1238 -0.3855 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2905 0.0272 -0.4828 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0105 -0.8064 -1.3192 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 -1.8223 -2.0957 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7178 3.0674 0.7297 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1151 1.7592 1.8677 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1292 2.0509 0.4039 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7333 2.6027 1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2663 2.2975 1.8055 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6781 0.6696 2.6497 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7594 0.1132 1.9263 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7343 -0.1360 1.9218 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7552 -2.2712 0.4822 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7146 -2.9253 -1.7354 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1255 -2.1970 -1.1372 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4055 -3.9457 0.6089 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5354 -0.0546 -1.2388 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4800 -0.0667 -2.1121 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1473 -0.0154 1.2996 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0139 2.4289 0.4542 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8673 1.8445 0.5128 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6553 0.5178 2.9248 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1816 -0.2033 -2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2664 0.0607 -2.5437 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3947 -0.8741 -0.9475 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5121 -1.3879 -2.5739 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1622 -2.6522 -1.3945 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0978 -2.1586 -2.8993 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 30 1 0 30 31 2 0 31 32 1 0 32 33 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 16 19 1 0 19 20 1 0 19 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 12 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 31 3 1 0 28 7 1 0 27 10 1 0 23 14 1 0 1 34 1 0 1 35 1 0 1 36 1 0 4 37 1 0 5 38 1 0 30 54 1 0 33 55 1 0 33 56 1 0 33 57 1 0 8 39 1 0 11 40 1 0 14 41 1 1 16 42 1 1 17 43 1 0 17 44 1 0 18 45 1 0 19 46 1 6 20 47 1 0 21 48 1 1 22 49 1 0 23 50 1 6 24 51 1 0 25 52 1 0 26 53 1 0 M END