RDKit 3D 56 58 0 0 0 0 0 0 0 0999 V2000 4.0282 2.5129 1.3754 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8723 2.2426 0.5825 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0565 0.8683 -0.0555 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2933 0.8441 -0.9296 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4411 1.1245 -0.2202 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3662 -0.4465 -1.6544 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8512 -1.6009 -1.0865 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9113 -2.8013 -1.7807 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4667 -2.8183 -3.0785 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9835 -1.6545 -3.6342 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9409 -0.5048 -2.9265 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6654 2.1486 1.4322 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 2.3101 2.6687 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4226 1.8829 0.8117 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7666 1.7893 1.6436 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7145 2.8069 1.1319 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4387 3.5448 0.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9385 2.9760 1.7206 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3751 0.4086 1.5709 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7879 0.0239 0.3278 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1699 0.1055 0.2811 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7520 -0.9187 -0.5634 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9928 -0.8031 -1.0684 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5276 -1.7939 -1.8726 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7850 -2.9229 -2.1678 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2459 -3.8388 -2.8959 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5481 -3.0067 -1.6466 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0646 -2.0157 -0.8658 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8996 -2.1328 -0.3965 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6836 0.0319 1.6774 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.1480 -1.2616 1.9111 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4795 0.2952 2.5559 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2860 -0.7400 3.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9855 2.0043 2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2827 3.5025 1.4442 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7495 3.0277 -0.1894 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1303 0.1024 0.7225 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1376 0.6730 -0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 1.6579 -1.6696 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1583 1.4830 -0.7785 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1888 -1.5371 -0.0639 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3022 -3.6814 -1.2862 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5182 -3.7596 -3.6101 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 -1.7101 -4.6562 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3637 1.7587 -0.2071 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4613 1.9555 2.6881 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1512 3.5876 2.4824 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 -0.3481 1.8913 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4105 1.0834 -0.2216 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5987 0.0630 -0.8586 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5239 -1.7300 -2.2944 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9987 -3.8632 -1.8771 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5047 0.7348 1.8622 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1337 -1.3053 1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6440 1.2076 3.1564 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1094 -1.5625 2.9574 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 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 2 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 19 1 0 19 20 1 0 20 21 1 0 21 30 1 0 30 31 1 0 30 32 1 0 32 33 1 0 21 22 1 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 25 27 1 0 27 28 1 0 28 29 2 0 15 16 1 0 16 18 1 0 16 17 2 0 11 6 1 0 32 19 1 0 28 22 1 0 1 34 1 0 1 35 1 0 2 36 1 6 3 37 1 0 3 38 1 0 4 39 1 6 5 40 1 0 7 41 1 0 8 42 1 0 9 43 1 0 10 44 1 0 14 45 1 0 15 46 1 1 19 48 1 1 21 49 1 6 30 53 1 6 31 54 1 0 32 55 1 1 33 56 1 0 23 50 1 0 24 51 1 0 27 52 1 0 18 47 1 0 M END