RDKit 3D 48 52 0 0 0 0 0 0 0 0999 V2000 -3.4574 1.0658 -1.4147 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2788 0.1445 -1.1022 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4836 0.7648 -0.0309 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4534 0.8500 1.0892 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7183 -0.6014 1.4754 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7397 -1.6401 1.1814 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 -1.3132 0.6536 N 0 0 1 0 0 4 0 0 0 0 0 0 0.5091 -1.7916 1.5184 O 0 0 0 0 0 1 0 0 0 0 0 0 -0.0874 -1.8329 -0.6147 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7881 -0.9917 -1.4681 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0492 0.4102 -1.1574 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1158 1.4531 -1.6885 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9053 1.9669 -0.6742 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4462 0.6915 -1.3720 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0981 0.1728 -0.2244 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3990 -0.2565 -0.0686 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8420 -0.6868 1.1567 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9857 -0.6872 2.2249 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6887 -0.2535 2.0453 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2049 0.1800 0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 0.6795 0.3336 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3420 0.0915 0.6637 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5092 1.9943 -0.8871 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4525 0.5597 -1.2527 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5080 1.3426 -2.5099 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8019 -0.8143 -0.8356 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -0.0239 -2.0716 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3921 1.3352 0.9778 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9278 1.3613 1.9506 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6958 -0.8951 0.9834 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0257 -0.5249 2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 -2.5356 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -2.1651 2.1788 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4651 -2.8160 -0.4369 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9939 -2.2290 -1.1201 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3035 -1.0083 -2.4992 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7593 -1.5325 -1.6959 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 2.3605 -1.9007 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3291 1.2031 -2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6526 2.4869 -1.3686 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5695 2.7785 -0.0438 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8518 1.1631 -2.1836 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1178 -0.2733 -0.8899 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8892 -1.0304 1.2718 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3256 -1.0251 3.2001 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0275 -0.2399 2.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9944 1.7967 0.5238 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3399 0.3159 1.7894 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 3 2 1 6 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 1 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 11 14 1 6 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 1 0 13 3 1 0 20 15 1 0 22 3 1 0 22 7 1 0 21 11 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 0 2 27 1 0 4 28 1 0 4 29 1 0 5 30 1 0 5 31 1 0 6 32 1 0 6 33 1 0 9 34 1 0 9 35 1 0 10 36 1 0 10 37 1 0 12 38 1 0 12 39 1 0 13 40 1 0 13 41 1 0 14 42 1 0 16 43 1 0 17 44 1 0 18 45 1 0 19 46 1 0 21 47 1 6 22 48 1 1 M CHG 2 7 1 8 -1 M END