RDKit 3D 53 57 0 0 0 0 0 0 0 0999 V2000 -4.8453 3.1355 1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2058 1.8981 1.8995 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2067 1.5027 1.0314 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9119 2.2576 0.0757 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5150 0.2091 1.2489 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5230 0.0087 0.1577 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0753 0.0626 0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7645 0.1400 -0.6163 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1330 0.4558 -0.2479 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6814 1.6077 0.1857 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9897 1.4489 0.4094 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9735 2.3335 0.8576 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2705 1.8870 0.9987 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5822 0.5775 0.6973 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5885 -0.2813 0.2542 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2718 0.1330 0.1001 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1166 -0.4735 -0.3057 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8466 -1.8402 -0.7423 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -2.1175 -1.1559 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6243 -1.0119 -1.4215 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7039 -1.4064 -1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6572 -1.3171 -0.5470 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0790 -1.4543 -1.0070 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2954 -0.6931 -2.3211 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0034 -0.9820 -0.1141 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5635 -0.8776 1.1815 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1307 -2.0648 1.7385 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2661 3.2252 0.6486 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6778 3.2205 2.3923 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1656 3.9963 1.8146 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0518 0.2687 2.2618 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6058 0.7962 -0.6452 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1499 -0.8660 1.1938 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0145 0.9747 1.2465 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3423 1.0156 -1.1757 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2005 2.5342 0.3457 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7432 3.3644 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0835 2.5122 1.3397 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5764 0.1639 0.7855 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8169 -1.3092 0.0142 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5986 -2.1462 -1.5284 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0920 -2.5184 0.1282 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9226 -2.7894 -0.4234 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5005 -2.7434 -2.0978 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0582 -0.8586 -2.6038 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6847 -2.4878 -2.0156 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4192 -2.1682 0.1499 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3549 -2.5194 -1.2442 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0933 -1.3471 -3.1725 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7421 0.2593 -2.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3839 -0.4047 -2.3864 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4218 -0.5244 1.7986 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7025 -2.7862 1.4044 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 26 1 0 26 27 1 0 26 25 1 0 25 23 1 0 23 24 1 0 23 22 1 0 22 21 1 0 21 20 1 0 20 19 1 0 19 18 1 0 18 17 1 0 17 9 2 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 15 16 2 0 9 8 1 0 8 7 1 0 7 6 1 0 6 5 1 0 6 22 1 0 8 20 1 0 16 17 1 0 16 11 1 0 1 28 1 0 1 29 1 0 1 30 1 0 5 31 1 1 26 52 1 1 27 53 1 0 23 48 1 6 24 49 1 0 24 50 1 0 24 51 1 0 22 47 1 1 21 45 1 0 21 46 1 0 19 43 1 0 19 44 1 0 18 41 1 0 18 42 1 0 10 36 1 0 12 37 1 0 13 38 1 0 14 39 1 0 15 40 1 0 8 35 1 6 7 33 1 0 7 34 1 0 6 32 1 6 M END