RDKit 3D 40 41 0 0 0 0 0 0 0 0999 V2000 2.8394 1.9532 1.6944 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0968 1.7500 0.2098 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0738 0.8316 -0.4688 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9453 -0.6027 0.1122 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2971 -1.3274 0.0066 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8961 -1.3570 -0.6376 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7642 -2.7894 -0.3164 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4154 -0.7867 -0.5931 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0312 -0.3751 0.5979 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3213 0.1593 0.5699 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0194 0.2684 -0.6345 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4281 -0.1593 -1.8219 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1209 -0.6490 -1.8168 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5586 -1.1823 -2.9983 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3028 0.7301 -0.7314 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7975 1.3793 0.4288 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1639 1.1192 1.7942 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6963 1.4387 2.8547 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9224 0.5511 1.7660 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8165 2.2999 1.8725 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5266 2.7053 2.0951 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9959 1.0293 2.2586 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0571 2.7281 -0.2857 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1149 1.3768 0.0583 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1049 1.3434 -0.4253 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3252 0.7641 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6795 -0.5557 1.1742 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0909 -0.7820 0.5248 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5953 -1.4597 -1.0392 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2586 -2.3169 0.4732 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6437 -3.3374 -0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 -3.2490 -0.8195 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6622 -2.9483 0.7635 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5145 -0.4873 1.5443 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9921 -0.1158 -2.7487 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4483 -1.2838 -2.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7882 -0.6472 -3.8274 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8558 1.1082 0.5132 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7475 2.4601 0.2512 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4606 0.4158 2.6549 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 4 6 1 0 6 7 1 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 11 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 13 8 1 0 19 10 1 0 1 20 1 0 1 21 1 0 1 22 1 0 2 23 1 0 2 24 1 0 3 25 1 0 3 26 1 0 4 27 1 1 5 28 1 0 5 29 1 0 5 30 1 0 7 31 1 0 7 32 1 0 7 33 1 0 9 34 1 0 12 35 1 0 14 36 1 0 14 37 1 0 16 38 1 0 16 39 1 0 19 40 1 0 M END