RDKit 3D 57 61 0 0 0 0 0 0 0 0999 V2000 7.9564 1.1287 -1.2022 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0768 1.5633 -0.0382 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6837 0.9895 -0.1094 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4660 -0.3874 -0.0277 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1686 -0.9149 -0.0924 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0456 -0.0854 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2772 1.2964 -0.2906 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5741 1.8269 -0.2369 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7274 -0.6234 -0.2878 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 0.1169 -0.5229 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3908 1.2486 -0.9371 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5406 -0.7895 -0.1085 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9234 -0.7655 -0.6921 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3580 -2.1853 -0.4404 N 0 0 0 0 0 4 0 0 0 0 0 0 -1.0437 -3.1015 -0.3325 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0134 -2.0836 -0.6541 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3955 -1.9732 -0.0991 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0216 -2.8815 0.4116 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0355 -3.7742 1.0332 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4657 -2.8402 2.0332 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -4.1741 -1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1859 -5.0323 -1.4574 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0988 -3.9703 -2.1936 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.8784 0.2342 -0.0915 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1319 0.2919 1.2906 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0363 1.2202 1.8152 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7048 2.0973 0.9673 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4479 2.0680 -0.4045 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5534 1.1358 -0.9321 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0459 2.9167 -1.2991 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6528 4.0313 -0.6335 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4519 3.5662 0.5734 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5957 2.9605 1.5494 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1404 0.0488 -1.1821 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4951 1.3734 -2.1664 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9273 1.6324 -1.1486 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5370 1.2594 0.9109 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0303 2.6593 -0.0196 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3058 -1.0728 0.0761 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0822 -1.9976 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4659 2.0127 -0.3784 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7025 2.9060 -0.2935 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5607 -0.7623 0.9904 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8864 -0.6505 -1.7836 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9318 -2.3278 0.3981 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8424 -2.6160 -1.2658 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1411 -2.0360 -1.7504 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0416 -4.1420 1.3016 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7296 -4.6209 1.0622 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3642 -3.2991 2.8903 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6364 -0.3849 1.9848 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2295 1.2503 2.8859 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 1.1358 -2.0081 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3107 4.5277 -1.3537 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8637 4.7377 -0.3467 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2215 2.8388 0.2879 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9475 4.4174 1.0499 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 7 1 0 7 8 2 0 6 9 1 0 9 10 1 0 10 11 2 0 10 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 2 0 15 19 1 1 19 20 1 0 15 21 1 0 21 22 2 0 21 23 1 0 13 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 28 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 8 3 1 0 17 9 1 0 16 12 1 0 29 24 1 0 33 27 1 0 1 34 1 0 1 35 1 0 1 36 1 0 2 37 1 0 2 38 1 0 4 39 1 0 5 40 1 0 7 41 1 0 8 42 1 0 12 43 1 1 13 44 1 6 14 45 1 0 14 46 1 0 16 47 1 6 19 48 1 0 19 49 1 0 20 50 1 0 25 51 1 0 26 52 1 0 29 53 1 0 31 54 1 0 31 55 1 0 32 56 1 0 32 57 1 0 M CHG 2 14 1 23 -1 M END