RDKit 3D 45 47 0 0 0 0 0 0 0 0999 V2000 5.1741 0.0265 -2.5289 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0439 0.0355 -1.5381 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1266 -0.9589 -1.4248 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1241 -0.7837 -0.5204 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8425 0.5365 -0.0128 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8386 -0.1381 1.0190 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1282 -1.4514 0.0899 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6901 -2.5743 -0.0123 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6005 0.2500 0.9451 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0641 1.5178 0.6691 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2907 2.4354 0.3826 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5766 1.7151 0.6859 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.3969 0.4396 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1045 -0.1768 1.5349 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7964 -1.3720 1.3222 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7727 -1.9700 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0767 -1.3853 -0.9802 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3965 -0.1843 -0.7673 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4382 -3.1490 -0.0974 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9473 2.5378 1.9216 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4346 2.1760 3.0251 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7693 3.4828 1.7168 O 0 0 0 0 0 1 0 0 0 0 0 0 1.2947 -0.3219 2.3948 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3782 0.8653 3.1774 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0568 1.1863 0.4218 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0252 1.2592 -0.6336 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2349 -2.2516 -2.2886 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2001 -3.0160 -1.9959 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3995 -2.3263 -3.2379 O 0 0 0 0 0 1 0 0 0 0 0 0 6.1344 -0.0330 -2.0075 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1281 -0.8000 -3.2427 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1561 0.9505 -3.1159 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3501 1.1462 -0.7792 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2802 -0.4536 1.2109 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7967 2.3439 -0.1879 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1147 0.2609 2.5321 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3433 -1.8320 2.1411 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0407 -1.8430 -1.9595 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8373 0.2595 -1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2845 -3.4502 -1.0092 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3159 1.3920 2.9557 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 1.5367 3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3815 0.5745 4.2333 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0051 1.3873 -0.1602 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8126 2.1563 -1.2243 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 1 0 5 6 1 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 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 16 19 1 0 12 20 1 0 20 21 2 0 20 22 1 0 6 23 1 1 23 24 1 0 5 25 1 0 25 26 1 0 3 27 1 0 27 28 2 0 27 29 1 0 26 2 1 0 7 4 1 0 18 13 1 0 1 30 1 0 1 31 1 0 1 32 1 0 5 33 1 6 9 34 1 0 12 35 1 6 14 36 1 0 15 37 1 0 17 38 1 0 18 39 1 0 19 40 1 0 24 41 1 0 24 42 1 0 24 43 1 0 26 44 1 0 26 45 1 0 M CHG 2 22 -1 29 -1 M END