RDKit 3D 54 55 0 0 0 0 0 0 0 0999 V2000 4.6599 -3.4279 0.6331 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1579 -2.3426 0.1057 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0473 -1.4250 -0.6494 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7238 -2.0550 0.2721 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9947 -2.8455 0.9139 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1652 -0.9313 -0.2649 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7774 -0.5740 -0.1508 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1392 -0.6211 -1.4713 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1332 -0.6439 -1.7732 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5117 -0.6882 -3.1738 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7192 -0.7105 -3.4814 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2443 -0.6255 -0.7844 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9247 -1.0781 0.4616 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6052 -2.2556 0.8222 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0926 -2.0813 0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9544 0.7148 -0.7892 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7816 1.4815 0.4863 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9759 2.7138 0.3232 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5482 3.7950 -0.1843 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5434 2.7829 0.7091 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0733 4.0703 0.6319 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3264 1.9056 -0.1640 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5428 2.5379 -0.5119 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 2.2308 0.4768 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5150 2.8907 0.7126 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9931 1.0459 1.1801 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6688 0.4514 2.1474 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6708 0.6757 0.6036 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0334 -4.1007 1.1807 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6992 -3.6477 0.5192 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8053 -0.3660 -0.4647 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1019 -1.6206 -0.3698 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9719 -1.5946 -1.7477 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3503 -1.4110 0.4498 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8322 -0.6375 -2.3253 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7804 -0.7026 -3.9596 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0025 -1.3636 -1.1899 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3715 -2.9793 -0.0132 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1919 -2.7033 1.7322 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6019 -2.6491 0.0017 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5560 -2.4931 1.7666 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4101 -1.0243 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0416 0.6204 -1.0763 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5277 1.3561 -1.6161 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3623 0.8024 1.2844 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8164 1.7199 0.8746 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5879 3.7529 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 4.7284 -0.3281 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4926 2.4735 1.7805 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5506 4.1849 -0.1414 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2175 1.7332 -1.1028 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -0.4185 2.6166 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 0.8021 2.4941 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0098 0.5474 1.5116 H 0 0 0 0 0 0 0 0 0 0 0 0 15 14 1 0 14 13 1 0 13 12 1 0 12 16 1 0 16 17 1 0 17 18 1 0 18 19 2 3 18 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 2 3 26 28 1 0 28 7 1 0 7 6 1 0 6 4 1 0 4 5 2 0 4 2 1 0 2 3 1 0 2 1 2 3 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 9 12 1 0 28 22 1 0 15 40 1 0 15 41 1 0 15 42 1 0 14 38 1 0 14 39 1 0 12 37 1 6 16 43 1 0 16 44 1 0 17 45 1 0 17 46 1 0 19 47 1 0 19 48 1 0 20 49 1 1 21 50 1 0 22 51 1 6 27 52 1 0 27 53 1 0 28 54 1 1 7 34 1 1 3 31 1 0 3 32 1 0 3 33 1 0 1 29 1 0 1 30 1 0 8 35 1 0 10 36 1 0 M END