RDKit 3D 39 40 0 0 0 0 0 0 0 0999 V2000 4.8962 1.3947 0.6623 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4899 0.9588 0.3348 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 1.9060 0.4604 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1189 1.5762 0.1753 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8477 0.2823 -0.2285 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 -0.6494 -0.3797 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2128 -0.3490 -0.1237 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2984 -1.3763 -0.2728 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3503 -1.8637 -0.8013 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0241 -1.7958 -0.9437 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7704 -2.7256 -1.2005 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -0.3457 -0.5937 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4617 -0.3485 0.5507 N 0 0 0 0 0 4 0 0 0 0 0 0 -2.9388 -0.1376 0.2102 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7027 -0.2657 1.5345 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4121 -1.2047 -0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1413 1.2989 -0.3409 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2068 2.1002 -0.3358 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3678 1.6642 -0.7955 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3774 0.6722 1.3291 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4824 1.4937 -0.2566 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9061 2.3617 1.1764 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6753 2.9229 0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3446 2.3344 0.2599 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0156 -2.1672 -0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2140 -0.9295 -0.6731 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5165 -1.8326 0.6976 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8816 -2.7101 -0.9654 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9006 0.1341 -1.4772 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3287 -1.2095 1.0949 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1913 0.4395 1.1547 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5389 -1.2450 1.9983 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7818 -0.1458 1.3854 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3890 0.5038 2.2497 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2031 -2.2132 -0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9450 -1.0882 -1.7574 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4945 -1.1417 -0.9352 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1993 1.0850 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4866 2.6166 -1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 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 14 16 1 0 14 17 1 0 17 18 2 0 17 19 1 0 7 2 1 0 12 5 1 0 1 20 1 0 1 21 1 0 1 22 1 0 3 23 1 0 4 24 1 0 8 25 1 0 8 26 1 0 8 27 1 0 9 28 1 0 12 29 1 6 13 30 1 0 13 31 1 0 15 32 1 0 15 33 1 0 15 34 1 0 16 35 1 0 16 36 1 0 16 37 1 0 19 38 1 0 19 39 1 0 M CHG 1 13 1 M END