RDKit 3D 63 64 0 0 0 0 0 0 0 0999 V2000 4.5528 2.7999 -1.1899 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1773 2.3094 -0.9652 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2946 2.5714 -1.7889 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8711 1.5675 0.1466 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5925 1.0585 0.4446 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0300 1.5682 1.7212 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4463 1.8921 1.6387 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7152 3.1188 0.8107 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7183 4.3821 1.6417 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9936 2.9639 0.0673 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6005 1.6084 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3548 1.3144 1.0316 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2532 0.6540 -0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9528 -0.6294 -0.9173 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.4302 -0.3138 -0.6023 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 -1.1769 -2.2097 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4451 -1.6807 -0.0064 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4227 -1.7595 0.7614 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0303 -2.0597 0.4649 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3102 -3.3824 1.1384 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -3.8471 1.1724 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5327 -4.4664 0.4488 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4143 -2.0060 -0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4463 -0.9124 -1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6343 -0.4726 0.3673 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0561 -0.8957 0.7692 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7398 -1.0914 1.1589 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6871 3.1419 -2.2404 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2971 2.0171 -0.9151 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7730 3.6967 -0.5563 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9327 1.3820 -0.3854 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5251 2.5365 1.9505 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1358 0.8372 2.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0449 1.0804 1.2466 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8296 2.1133 2.6664 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1512 3.1985 0.0892 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0707 4.3232 2.5273 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3304 5.2053 0.9996 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7313 4.6817 1.9562 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7586 3.6690 0.4755 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8141 3.2776 -1.0029 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1644 0.4855 -1.0705 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5505 1.1685 -1.9157 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5884 -0.5851 0.4801 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6712 0.7278 -0.8043 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0942 -1.0026 -1.1691 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3818 -2.0946 -2.0919 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1667 -2.5440 -0.0548 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5615 -1.6040 1.8576 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0779 -3.3372 2.1777 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6708 -4.9544 1.4182 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3412 -3.4312 1.9788 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2488 -3.8198 0.2137 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5737 -4.4582 0.8152 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4232 -4.4448 -0.6357 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0889 -5.4354 0.8029 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7811 -2.9667 -1.3731 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3993 -1.7079 -1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3784 -1.2491 -1.5359 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1019 -0.0371 -1.6525 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1334 -1.1878 1.8133 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7693 -0.0628 0.6164 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3972 -1.7342 0.1352 H 0 0 0 0 0 0 0 0 0 0 0 0 21 20 1 0 20 22 1 0 19 20 1 1 19 23 1 0 23 24 1 0 24 25 1 0 25 26 1 1 25 27 1 0 25 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 14 16 1 6 14 17 1 0 17 18 2 0 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 27 19 1 0 18 19 1 0 21 51 1 0 21 52 1 0 21 53 1 0 20 50 1 0 22 54 1 0 22 55 1 0 22 56 1 0 23 57 1 0 23 58 1 0 24 59 1 0 24 60 1 0 26 61 1 0 26 62 1 0 26 63 1 0 5 31 1 6 6 32 1 0 6 33 1 0 7 34 1 0 7 35 1 0 8 36 1 6 9 37 1 0 9 38 1 0 9 39 1 0 10 40 1 0 10 41 1 0 13 42 1 0 13 43 1 0 15 44 1 0 15 45 1 0 15 46 1 0 16 47 1 0 17 48 1 0 18 49 1 0 1 28 1 0 1 29 1 0 1 30 1 0 M END