HMDB0002710 RDKit 3D Prostaglandin J2 54 54 0 0 0 0 0 0 0 0999 V2000 7.0982 -2.1104 -0.6658 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1364 -0.9002 0.2431 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9147 0.3531 -0.5649 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5788 0.3427 -1.2718 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4597 0.2375 -0.2587 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 0.2244 -0.9129 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8701 1.3797 -1.6583 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0587 0.1329 0.1499 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8125 -0.0360 -0.1772 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2852 -0.1377 0.7652 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0021 0.0194 2.1888 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0169 -0.2042 2.8431 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2455 0.5340 2.7733 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9921 1.0781 1.8324 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3172 0.9761 0.5539 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2130 0.6982 -0.6332 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9844 -0.5364 -0.5223 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3037 -0.5211 -0.5361 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1540 0.6649 -0.6572 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0344 0.7465 0.5918 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9151 -0.4420 0.7764 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8865 -0.6860 -0.2991 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5795 -1.7255 -0.2772 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0462 0.2107 -1.3276 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0628 -2.4947 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7860 -2.8658 -0.2221 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4150 -1.8082 -1.6842 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1542 -0.8106 0.7033 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4306 -0.9676 1.0793 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9103 1.2104 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7334 0.4851 -1.2917 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4667 1.3449 -1.7561 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5066 -0.4902 -1.9842 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4912 1.0485 0.4781 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5642 -0.7268 0.2918 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9756 -0.6603 -1.5574 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3667 1.1592 -2.4932 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3844 0.2174 1.1585 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 -0.1096 -1.2484 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -1.1039 0.6586 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4721 0.4510 3.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9646 1.5158 2.0888 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7756 1.9232 0.3318 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7314 1.5992 -0.9353 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4749 0.5084 -1.4853 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5255 -1.5180 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8676 -1.4810 -0.4509 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6680 1.6282 -0.7388 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8067 0.5793 -1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4101 0.8424 1.5032 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6324 1.6951 0.5545 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5282 -0.3201 1.7202 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2912 -1.3504 0.9943 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8986 0.2005 -1.8939 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 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 15 10 1 0 1 25 1 0 1 26 1 0 1 27 1 0 2 28 1 0 2 29 1 0 3 30 1 0 3 31 1 0 4 32 1 0 4 33 1 0 5 34 1 0 5 35 1 0 6 36 1 6 7 37 1 0 8 38 1 0 9 39 1 0 10 40 1 1 13 41 1 0 14 42 1 0 15 43 1 6 16 44 1 0 16 45 1 0 17 46 1 0 18 47 1 0 19 48 1 0 19 49 1 0 20 50 1 0 20 51 1 0 21 52 1 0 21 53 1 0 24 54 1 0 M END