RDKit 3D 122125 0 0 0 0 0 0 0 0999 V2000 13.6643 2.9380 -0.5927 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9921 2.1988 0.5412 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6363 0.8504 0.7689 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5335 -0.0038 -0.4634 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0537 -0.2306 -0.8218 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0473 -1.0911 -2.0367 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6497 -1.3757 -2.5061 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8837 -2.0740 -1.4257 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4656 -2.4482 -1.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8161 -3.1482 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7544 -2.2800 0.5714 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9543 -1.0337 0.3638 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4925 -1.2958 0.0114 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8112 -2.0517 1.0939 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3652 -2.3519 0.9029 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4742 -1.2010 0.7661 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8442 -0.0131 0.6348 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1081 -1.4501 0.7907 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1546 -0.4045 0.6724 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5186 -0.1721 2.0256 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9667 0.2283 1.8718 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1194 1.2379 0.7285 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2218 2.4170 1.0247 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 0.5467 -0.5121 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2565 0.9726 -1.6515 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1491 2.1263 -1.7172 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9748 2.4217 -0.5009 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.3857 2.0537 -0.7722 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.1542 2.8033 -1.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5007 2.0366 -1.6162 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6205 2.2397 -0.0955 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.8257 1.6933 0.5171 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.0093 2.2839 1.9063 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0888 0.2559 0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0183 -0.3453 -0.2378 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2602 -1.8084 -0.2452 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.9811 -2.4032 -1.5791 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6563 -2.1589 0.2171 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8942 -1.6674 1.6429 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7054 -1.6466 -0.7121 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2857 2.0859 0.4679 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.9419 3.2386 1.3974 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9066 0.7936 1.1335 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4158 0.5790 1.1542 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5547 1.7225 0.7555 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8397 -0.6216 -0.4181 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0333 3.0085 -1.5026 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6264 2.4264 -0.8393 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8982 3.9866 -0.2629 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9109 2.1010 0.4389 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1510 2.7688 1.5039 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7090 0.9489 1.0156 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0824 0.3596 1.5904 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9788 0.5240 -1.3311 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9937 -0.9861 -0.3002 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5421 -0.7036 0.0505 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5947 0.7357 -1.0236 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5864 -2.0413 -1.7645 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6708 -0.6670 -2.8661 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1240 -0.4185 -2.7899 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6563 -2.0061 -3.4407 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8245 -1.3308 -0.5754 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4081 -3.0025 -1.1539 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8797 -1.6133 -2.2087 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5412 -3.2096 -2.6306 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8375 -3.5453 -0.9286 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4982 -4.0160 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7673 -2.0279 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2724 -2.8683 1.3966 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0454 -0.4036 1.2825 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4619 -0.4584 -0.4398 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0310 -0.2786 -0.0616 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4878 -1.8247 -0.9464 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3220 -3.0581 1.1628 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9856 -1.5871 2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2637 -3.0773 0.0454 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0582 -2.9788 1.7942 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7217 0.5287 0.4915 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0688 0.5063 2.6613 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4828 -1.1772 2.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5008 -0.7171 1.6473 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2957 0.6973 2.8368 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6081 2.2920 1.9374 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5308 2.6537 0.1939 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8098 3.3587 1.2057 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9829 0.4423 -2.5612 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6035 3.0500 -2.0859 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8595 1.9344 -2.5896 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8473 3.5422 -0.3477 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3535 0.9782 -1.1424 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2833 3.8479 -1.4746 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8166 2.7100 -2.8117 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2706 1.0069 -1.8842 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3056 2.5260 -2.1633 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8202 3.3787 -0.0851 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6988 2.1461 -0.0618 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9863 1.8475 2.2726 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1828 2.1083 2.5872 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2054 3.3744 1.8807 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4899 -0.3895 1.1165 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6396 0.2735 -0.8652 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5704 -2.2572 0.5199 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2455 -3.4919 -1.5087 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7018 -1.9942 -2.3196 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9376 -2.2776 -1.8907 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7253 -3.2677 0.2399 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9716 -1.8743 2.2484 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1757 -0.6164 1.6945 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6997 -2.2689 2.1055 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6522 -1.3762 -0.1986 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3398 -0.7651 -1.2666 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9704 -2.4532 -1.4494 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2493 3.9682 0.9906 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8970 3.8391 1.5422 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7226 2.8897 2.4358 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3970 0.5944 2.0903 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2845 0.0000 0.4163 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1650 0.2886 2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0945 -0.2879 0.5065 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5492 2.4438 1.6348 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3064 -0.8185 -1.3487 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4868 -1.4801 -0.1055 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 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 1 22 45 1 0 45 44 1 0 44 43 1 0 43 41 1 0 41 42 1 1 41 31 1 0 31 30 1 0 30 29 1 0 29 28 1 0 28 27 1 0 27 26 1 0 26 25 1 0 25 24 2 0 24 46 1 0 31 32 1 0 32 33 1 0 32 34 1 0 34 35 2 0 35 36 1 0 36 37 1 0 36 38 1 0 38 39 1 0 38 40 1 0 46 19 1 0 24 22 1 0 27 45 1 0 28 41 1 0 1 47 1 0 1 48 1 0 1 49 1 0 2 50 1 0 2 51 1 0 3 52 1 0 3 53 1 0 4 54 1 0 4 55 1 0 5 56 1 0 5 57 1 0 6 58 1 0 6 59 1 0 7 60 1 0 7 61 1 0 8 62 1 0 8 63 1 0 9 64 1 0 9 65 1 0 10 66 1 0 10 67 1 0 11 68 1 0 11 69 1 0 12 70 1 0 12 71 1 0 13 72 1 0 13 73 1 0 14 74 1 0 14 75 1 0 15 76 1 0 15 77 1 0 19 78 1 6 20 79 1 0 20 80 1 0 21 81 1 0 21 82 1 0 23 83 1 0 23 84 1 0 23 85 1 0 45120 1 1 44118 1 0 44119 1 0 43116 1 0 43117 1 0 42113 1 0 42114 1 0 42115 1 0 31 95 1 6 30 93 1 0 30 94 1 0 29 91 1 0 29 92 1 0 28 90 1 6 27 89 1 1 26 87 1 0 26 88 1 0 25 86 1 0 46121 1 0 46122 1 0 32 96 1 6 33 97 1 0 33 98 1 0 33 99 1 0 34100 1 0 35101 1 0 36102 1 1 37103 1 0 37104 1 0 37105 1 0 38106 1 0 39107 1 0 39108 1 0 39109 1 0 40110 1 0 40111 1 0 40112 1 0 M END