RDKit 3D 56 57 0 0 0 0 0 0 0 0999 V2000 3.3798 3.0358 -1.6666 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8308 1.8564 -0.7539 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6355 2.5364 0.3449 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6333 1.1263 -0.2881 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7874 -0.0889 0.5575 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3995 -0.5252 0.8235 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1175 -1.5384 1.5072 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1347 -2.3064 2.0531 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2747 -1.9638 1.7670 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5229 -3.3799 1.3181 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 -3.6512 -0.0947 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2869 -3.5767 -1.0734 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7245 -3.8952 -2.2472 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5567 -4.1679 -2.0539 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8042 -4.0192 -0.7412 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2838 -1.0282 1.4593 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5042 -0.3610 0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7103 -0.4525 -0.7084 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 0.5828 0.3224 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1120 1.9251 0.0631 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5841 0.2479 -0.7977 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6838 1.2465 -0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8741 1.1338 -0.1015 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6242 2.2209 -0.3303 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9478 3.0337 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7790 2.4303 -1.4206 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5332 0.0767 1.7806 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7781 0.0236 1.8782 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8110 0.3169 2.9595 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2696 3.6690 -1.8046 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6106 3.6246 -1.1458 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0292 2.5721 -2.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5005 1.2411 -1.3454 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7999 3.6263 0.0576 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1254 2.5253 1.3174 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6227 2.0656 0.4434 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9475 1.8727 0.2481 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0315 0.8597 -1.2125 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2372 -0.8981 -0.0699 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0857 -2.5038 3.0439 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3052 -2.0536 2.9174 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5786 -3.6220 1.5786 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0995 -4.0447 1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3183 -3.3117 -0.9414 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2402 -4.4557 -2.8514 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7405 -4.1743 -0.3195 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3931 0.4172 -1.1256 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2199 0.5727 1.2655 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 1.9806 -0.8951 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8710 2.6426 0.1863 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0879 0.3440 -1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0158 -0.7555 -0.7325 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1171 0.2661 0.5238 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2923 4.0131 -1.5324 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0412 2.8371 -2.0418 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1160 -0.1491 3.8191 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 9 16 1 0 16 17 2 0 17 18 1 0 17 19 1 0 19 20 1 0 19 21 1 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 5 27 1 0 27 29 1 0 27 28 2 0 15 11 1 0 26 22 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 0 3 34 1 0 3 35 1 0 3 36 1 0 4 37 1 0 4 38 1 0 5 39 1 6 8 40 1 0 9 41 1 1 10 42 1 0 10 43 1 0 12 44 1 0 14 45 1 0 15 46 1 0 18 47 1 0 19 48 1 1 20 49 1 0 20 50 1 0 21 51 1 0 21 52 1 0 23 53 1 0 25 54 1 0 26 55 1 0 29 56 1 0 M END