RDKit 3D 113112 0 0 0 0 0 0 0 0999 V2000 14.0896 -4.2760 0.0475 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9149 -4.1352 -0.8708 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7792 -3.4068 -0.1625 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2280 -2.0193 0.2749 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0206 -1.3830 0.9699 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3284 -0.0332 1.4491 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6837 1.0122 1.0519 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5991 1.0197 0.1075 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 2.1581 -0.2233 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9139 2.2524 -1.1536 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3920 3.3662 -1.4077 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3659 1.0791 -1.8425 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3779 0.3082 -1.0315 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1791 1.0645 -0.5859 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3272 1.6466 -1.6671 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8076 0.5812 -2.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0184 -0.4564 -1.8976 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8208 -0.0004 -1.1502 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8332 0.6237 -2.0508 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9841 0.8106 -3.2632 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3566 1.0239 -1.4674 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4373 1.6322 -2.1005 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5409 1.8515 -1.0736 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0924 2.8064 0.0152 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1325 2.9933 0.9166 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6270 4.0345 2.1320 P 0 0 2 0 0 5 0 0 0 0 0 0 -1.2311 4.4998 1.8221 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5799 3.2485 3.6382 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7129 5.3274 2.2125 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8735 4.9622 1.5482 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8131 6.1523 1.6543 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.0066 5.8832 1.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0177 6.4007 3.1414 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8470 7.4788 3.3293 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9099 0.6065 -0.5648 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1767 0.0676 -0.6967 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0460 0.7159 -1.2952 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4275 -1.2423 -0.1229 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8186 -1.7994 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1564 -1.9782 -1.7326 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4668 -2.5529 -2.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7185 -1.9153 -1.7289 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1392 -1.6809 -0.3522 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2557 -2.8927 0.5283 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6997 -2.4251 1.9123 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8471 -3.5872 2.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8541 -4.5956 2.4143 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4965 -4.2088 3.1952 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7672 -4.0450 1.0835 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9687 -3.6957 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4176 -5.3421 0.0633 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5488 -5.1303 -1.1545 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2363 -3.5845 -1.7785 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4278 -3.9872 0.6969 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9701 -3.2629 -0.9056 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4434 -1.4369 -0.6262 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0744 -2.1098 0.9888 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7389 -2.0296 1.8606 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1702 -1.3715 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1483 0.1099 2.1862 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9953 1.9778 1.4755 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2306 0.1317 -0.3673 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3726 3.0771 0.2527 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9556 1.3438 -2.8509 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2172 0.3821 -2.0782 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1005 -0.5912 -1.6423 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8860 -0.0806 -0.1183 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5612 0.3962 0.0537 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4869 1.9038 0.0771 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9219 2.3455 -2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5345 2.2573 -1.2104 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2411 1.0651 -3.4052 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7294 0.0738 -3.0049 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6745 -1.1077 -1.2414 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6467 -1.1772 -2.6903 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3194 -0.9180 -0.7305 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0694 0.6602 -0.2839 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8609 1.0444 -2.9395 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1867 2.6446 -2.5338 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3956 2.3047 -1.5927 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7788 3.7362 -0.4651 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2389 2.4021 0.5925 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 2.4149 3.5689 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5852 4.7899 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2880 4.0666 2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3474 7.0585 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6871 6.5645 1.2288 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0174 6.5179 3.5862 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4603 5.4450 3.5372 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3271 8.2909 3.1895 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2435 -1.2709 0.9952 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7116 -1.9800 -0.5543 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4828 -1.0569 0.1722 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8206 -2.7760 0.2181 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9629 -1.0576 -2.3471 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3804 -2.7127 -2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4278 -3.6623 -1.8938 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4536 -2.5634 -3.2442 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5545 -2.5009 -2.2408 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7749 -0.9250 -2.2719 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2472 -1.3462 -0.4443 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7228 -0.8317 0.2069 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3479 -3.4659 0.6677 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0213 -3.5610 0.0854 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9626 -1.7310 2.3554 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6609 -1.8777 1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2292 -3.1502 3.8202 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7549 -5.4771 3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6961 -4.9802 1.4043 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8711 -4.1677 2.5804 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9049 -3.4256 3.6837 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6898 -4.9900 3.9601 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0225 -4.6422 2.3057 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 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 26 25 1 6 26 27 2 0 26 28 1 0 26 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 31 33 1 0 33 34 1 0 23 35 1 0 35 36 1 0 36 37 2 0 36 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 46 48 1 0 1 49 1 0 1 50 1 0 1 51 1 0 2 52 1 0 2 53 1 0 3 54 1 0 3 55 1 0 4 56 1 0 4 57 1 0 5 58 1 0 5 59 1 0 6 60 1 0 7 61 1 0 8 62 1 0 9 63 1 0 12 64 1 0 12 65 1 0 13 66 1 0 13 67 1 0 14 68 1 0 14 69 1 0 15 70 1 0 15 71 1 0 16 72 1 0 16 73 1 0 17 74 1 0 17 75 1 0 18 76 1 0 18 77 1 0 22 78 1 0 22 79 1 0 23 80 1 6 24 81 1 0 24 82 1 0 28 83 1 0 30 84 1 0 30 85 1 0 31 86 1 6 32 87 1 0 33 88 1 0 33 89 1 0 34 90 1 0 38 91 1 0 38 92 1 0 39 93 1 0 39 94 1 0 40 95 1 0 40 96 1 0 41 97 1 0 41 98 1 0 42 99 1 0 42100 1 0 43101 1 0 43102 1 0 44103 1 0 44104 1 0 45105 1 0 45106 1 0 46107 1 0 47108 1 0 47109 1 0 47110 1 0 48111 1 0 48112 1 0 48113 1 0 M END