RDKit 3D 100105 0 0 0 0 0 0 0 0999 V2000 -7.0947 0.9452 -1.8861 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9355 0.5994 -0.3975 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9476 1.4255 0.3353 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1895 -0.8642 -0.2766 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5935 -1.5382 0.9109 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2094 -1.0335 1.2516 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.3645 -0.1017 2.4258 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4823 0.1359 2.9514 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 0.5314 2.9704 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3362 -2.1944 1.5879 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8532 -1.9261 1.4701 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4941 -1.3770 0.0874 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0898 -2.2660 -0.9975 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2534 -0.1141 0.0546 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6930 1.0324 0.0785 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2207 1.1879 0.1436 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4997 -0.0390 0.6297 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9763 0.1733 0.4512 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7094 -0.6141 1.4659 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2298 1.6552 0.7965 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6728 2.0356 0.6879 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6691 3.4588 0.7794 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 1.6452 -0.6127 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7057 1.6858 -0.5816 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5435 2.4947 -1.2229 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9552 3.3610 -1.9794 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9665 2.5553 -1.2071 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9538 1.9572 -0.6581 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1524 0.8745 0.2607 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4679 0.5134 0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7442 -0.5073 1.5043 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7422 -1.2442 2.0659 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0507 -2.2786 2.9484 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4534 -0.9345 1.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1741 0.1061 0.8499 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8370 0.3639 -1.2252 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7796 -0.7908 -0.9994 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9248 0.5645 -2.7568 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1319 1.5986 -3.1817 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3903 0.0618 -0.9640 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8982 -1.1390 -1.6753 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5924 -1.2581 -1.4964 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0212 -1.2824 -0.0383 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4518 -2.5647 0.5278 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7214 -0.2671 0.0325 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.4956 0.9959 -0.0383 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2851 0.4100 -2.4086 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0868 2.0349 -2.0452 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0533 0.4825 -2.1994 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4404 0.8817 1.1752 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8002 1.7072 -0.3495 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5131 2.3906 0.6665 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9534 -1.4060 -1.2404 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3106 -0.9835 -0.1858 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2715 -1.4537 1.8074 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5768 -2.6426 0.6927 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1982 1.5278 3.1222 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6458 -3.1563 1.1198 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4959 -2.3850 2.6941 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6462 -1.0708 2.1786 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2865 -2.7655 1.8093 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1459 -1.6871 -1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0786 -2.6587 -0.7589 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4512 -3.1483 -1.2117 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 1.9610 0.0524 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0549 1.9611 0.9547 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9268 1.5472 -0.8484 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -0.1344 1.7147 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9192 -1.6577 1.2644 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6556 -0.1769 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0484 -0.6302 2.3888 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8721 1.9014 1.8069 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7138 2.3221 0.0425 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 1.7355 1.5824 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4855 3.7405 0.3185 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0208 2.4641 -1.3156 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3861 3.4107 -1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9643 2.4101 -0.9917 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2792 1.0888 0.1983 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7892 -0.7371 1.7537 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1287 -2.0975 3.9573 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6441 -1.5059 2.1694 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1412 0.2788 0.6474 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8771 -1.1332 0.0259 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7545 -0.5118 -1.4657 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4349 -1.6598 -1.6068 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8666 -0.3681 -3.3087 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0004 0.9071 -2.8902 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6513 2.3211 -3.6151 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8569 0.9292 -1.4855 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0191 -0.9326 -2.7914 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -2.0673 -1.5248 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9182 -2.1356 -2.0476 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0527 -0.3518 -1.9525 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4469 -2.9311 -0.0548 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -3.4337 0.3389 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2794 -2.5593 1.6005 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0008 -0.8742 -0.8558 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5491 1.4758 0.9727 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1181 1.7424 -0.7537 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 10 1 0 10 11 1 0 11 12 1 0 12 13 1 6 12 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 1 18 20 1 0 20 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 25 27 1 0 27 28 2 0 28 29 1 0 29 30 2 0 30 31 1 0 31 32 2 0 32 33 1 0 32 34 1 0 34 35 2 0 23 36 1 0 36 37 1 1 36 38 1 0 38 39 1 0 36 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 1 14 45 1 0 45 46 1 0 6 7 1 1 7 9 1 0 7 8 2 0 46 2 1 0 45 6 1 0 43 12 1 0 43 17 1 0 40 18 1 0 35 29 1 0 1 47 1 0 1 48 1 0 1 49 1 0 3 50 1 0 3 51 1 0 3 52 1 0 4 53 1 0 4 54 1 0 5 55 1 0 5 56 1 0 10 58 1 0 10 59 1 0 11 60 1 0 11 61 1 0 13 62 1 0 13 63 1 0 13 64 1 0 15 65 1 0 16 66 1 0 16 67 1 0 17 68 1 1 19 69 1 0 19 70 1 0 19 71 1 0 20 72 1 0 20 73 1 0 21 74 1 1 22 75 1 0 23 76 1 6 27 77 1 0 28 78 1 0 30 79 1 0 31 80 1 0 33 81 1 0 34 82 1 0 35 83 1 0 37 84 1 0 37 85 1 0 37 86 1 0 38 87 1 0 38 88 1 0 39 89 1 0 40 90 1 6 41 91 1 0 41 92 1 0 42 93 1 0 42 94 1 0 44 95 1 0 44 96 1 0 44 97 1 0 45 98 1 6 46 99 1 0 46100 1 0 9 57 1 0 M END