RDKit 3D 58 60 0 0 0 0 0 0 0 0999 V2000 8.4179 -0.0040 -1.3353 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9320 0.0088 -1.0122 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2610 1.2877 -1.5204 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7782 1.3474 -1.1531 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1020 0.2605 -1.7910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8839 -0.0412 -1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9726 0.9364 -0.8291 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7443 0.5682 -0.2712 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4211 -0.7800 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3203 -1.7579 -0.5552 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5509 -1.4003 -1.1304 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5089 -2.4674 -1.5728 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -1.2302 0.4311 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3793 -2.2735 -0.0128 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6675 -0.4339 1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2243 0.3710 2.3982 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4990 0.7941 3.1104 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6039 1.4802 4.1192 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5827 0.2647 2.4249 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1535 -0.6114 1.3649 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7651 -0.1998 0.0286 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5962 1.1305 -0.4212 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0678 1.5520 -1.6673 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7196 0.6564 -2.5057 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9109 -0.6608 -2.0929 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4410 -1.0826 -0.8342 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7504 -2.4607 -0.4546 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.2422 -2.6484 0.6673 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6081 -3.3368 -1.3187 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.9210 0.1941 2.9941 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5708 1.5750 3.1554 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1523 2.2318 4.3466 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0971 0.7480 2.8125 O 0 0 0 0 0 1 0 0 0 0 0 0 8.9309 0.8351 -0.8551 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8760 -0.9313 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5862 0.0633 -2.4148 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7985 -0.0771 0.0729 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4620 -0.8703 -1.4672 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7694 2.1647 -1.1028 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3653 1.3328 -2.6115 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3665 2.2959 -1.5164 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6706 1.2973 -0.0619 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1916 1.9946 -0.9304 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 1.3468 0.0525 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0531 -2.8077 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3791 -2.4900 -0.9101 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8392 -2.2845 -2.6004 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0426 -3.4579 -1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3897 -1.6341 1.6699 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0698 1.8512 0.2064 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9086 2.5810 -1.9826 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0771 0.9835 -3.4786 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4274 -1.3531 -2.7526 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8442 -0.3094 3.9643 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5436 -0.4106 2.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6559 1.4614 3.2282 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3543 2.2244 2.3031 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1708 2.1262 4.3898 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 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 9 13 1 0 13 14 2 0 13 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 27 29 1 0 19 30 1 0 30 31 1 0 31 32 1 0 16 33 1 0 11 6 1 0 20 15 1 0 26 21 1 0 1 34 1 0 1 35 1 0 1 36 1 0 2 37 1 0 2 38 1 0 3 39 1 0 3 40 1 0 4 41 1 0 4 42 1 0 7 43 1 0 8 44 1 0 10 45 1 0 12 46 1 0 12 47 1 0 12 48 1 0 20 49 1 1 22 50 1 0 23 51 1 0 24 52 1 0 25 53 1 0 30 54 1 0 30 55 1 0 31 56 1 0 31 57 1 0 32 58 1 0 M CHG 3 27 1 29 -1 33 -1 M END