RDKit 3D 128127 0 0 0 0 0 0 0 0999 V2000 13.7165 -1.8629 -0.3825 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6157 -0.7409 -0.9107 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8403 0.2821 0.1807 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7200 1.3968 -0.2911 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1124 2.1182 -1.4788 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7703 2.6603 -1.1142 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1805 3.4306 -2.3058 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7842 3.9138 -1.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9577 2.7019 -1.5713 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4822 2.4710 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6538 1.2331 -0.1223 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3275 1.5581 0.4062 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1777 1.2640 -0.1773 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9230 1.6448 0.4594 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7211 1.4100 -0.0157 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5502 1.8838 0.7969 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9018 0.7438 1.3208 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5682 2.6317 -0.0536 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4176 3.1601 0.7448 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5496 2.1551 1.4059 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1402 1.2997 0.4341 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3101 1.6852 0.0841 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 0.1303 -0.1435 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5479 -0.5738 -1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6863 -1.0954 -0.2259 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0546 -2.2362 0.6152 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 -2.9053 1.3468 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3058 -4.1544 2.2377 P 0 0 1 0 0 5 0 0 0 0 0 0 0.1980 -4.0412 2.0869 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7186 -4.0904 3.8726 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8121 -5.6329 1.6264 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1354 -5.6343 1.1994 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4580 -7.0189 0.6715 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.7815 -7.0712 0.2278 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5415 -7.2924 -0.5097 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 -8.5634 -0.9823 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6586 -1.7139 -1.1057 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9967 -1.2554 -1.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1760 -0.3524 -0.1478 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1206 -1.7530 -1.7869 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4322 -1.1083 -1.3776 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8122 -1.3718 0.0364 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1049 -0.6380 0.3407 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5626 -0.8535 1.7423 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8222 -0.0781 2.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6525 1.4158 1.8436 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9068 2.1720 2.1316 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0719 1.8599 1.2586 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8038 2.1596 -0.2038 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0334 1.8242 -1.0091 C 0 0 2 0 0 0 0 0 0 0 0 0 -13.4075 0.3758 -0.8865 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8717 2.1573 -2.4737 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6003 3.6329 -2.6998 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8534 -2.7985 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6746 -1.5354 -0.4188 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0081 -2.0390 0.6819 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5765 -1.1759 -1.2181 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0812 -0.2908 -1.7565 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8851 0.7033 0.5612 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3583 -0.1928 1.0594 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8416 2.1174 0.5415 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7019 0.9805 -0.5496 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9901 1.4231 -2.3287 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8023 2.9057 -1.8118 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8590 3.3704 -0.2574 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0493 1.8837 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7749 4.3239 -2.5113 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1503 2.7806 -3.1747 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3442 4.4869 -2.6868 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9063 4.5376 -0.9831 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7610 2.0147 -2.3988 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6922 3.1680 0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5732 0.6662 -1.0903 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2062 0.5672 0.5789 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2873 2.0847 1.3664 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1872 0.7532 -1.1143 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9732 2.1761 1.4213 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 0.8979 -0.9504 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8884 2.4741 1.6618 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6033 0.2351 1.7981 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1704 1.8959 -0.8117 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0894 3.4676 -0.6016 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7934 3.8919 1.5176 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8305 3.8139 0.0287 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0766 1.5978 2.2139 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2561 2.7296 1.9855 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0432 -1.4401 -1.4263 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8868 0.1068 -1.8653 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 -0.3447 0.4153 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6767 -2.9741 -0.1508 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1937 -1.8912 1.1843 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6059 -3.1292 4.1405 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8248 -5.3728 2.0297 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3032 -4.9269 0.3492 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3112 -7.7384 1.4787 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1602 -7.9750 0.4626 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6411 -6.5178 -1.2863 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4775 -7.3015 -0.1857 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2641 -9.2086 -0.5446 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2026 -2.8440 -1.6017 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0087 -1.6063 -2.8741 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3765 -0.0300 -1.5676 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2047 -1.5359 -2.0579 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0530 -1.2310 0.7955 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0843 -2.4715 0.0904 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9284 0.4360 0.1428 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8801 -0.9854 -0.3741 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7890 -0.4376 2.4342 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6791 -1.9179 2.0083 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1764 -0.3331 3.0175 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6177 -0.3790 1.2814 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2884 1.7063 0.8536 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8860 1.7250 2.5801 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6717 3.2596 2.0221 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2172 1.9591 3.1869 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9087 2.5431 1.5906 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4447 0.8360 1.3758 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6068 3.2457 -0.3636 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9289 1.6324 -0.5957 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8761 2.4557 -0.6296 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1240 0.0686 -1.6565 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5168 -0.2830 -0.8884 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9334 0.2731 0.1027 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8525 1.9188 -2.9638 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1195 1.5237 -2.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8016 4.1548 -1.7423 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5541 3.7447 -3.0602 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2808 4.0368 -3.4958 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 2 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 28 27 1 6 28 29 2 0 28 30 1 0 28 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 25 37 1 0 37 38 1 0 38 39 2 0 38 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 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 50 52 1 0 52 53 1 0 1 54 1 0 1 55 1 0 1 56 1 0 2 57 1 0 2 58 1 0 3 59 1 0 3 60 1 0 4 61 1 0 4 62 1 0 5 63 1 0 5 64 1 0 6 65 1 0 6 66 1 0 7 67 1 0 7 68 1 0 8 69 1 0 8 70 1 0 9 71 1 0 10 72 1 0 11 73 1 0 11 74 1 0 12 75 1 0 13 76 1 0 14 77 1 0 15 78 1 0 16 79 1 1 17 80 1 0 18 81 1 0 18 82 1 0 19 83 1 0 19 84 1 0 20 85 1 0 20 86 1 0 24 87 1 0 24 88 1 0 25 89 1 1 26 90 1 0 26 91 1 0 30 92 1 0 32 93 1 0 32 94 1 0 33 95 1 1 34 96 1 0 35 97 1 0 35 98 1 0 36 99 1 0 40100 1 0 40101 1 0 41102 1 0 41103 1 0 42104 1 0 42105 1 0 43106 1 0 43107 1 0 44108 1 0 44109 1 0 45110 1 0 45111 1 0 46112 1 0 46113 1 0 47114 1 0 47115 1 0 48116 1 0 48117 1 0 49118 1 0 49119 1 0 50120 1 1 51121 1 0 51122 1 0 51123 1 0 52124 1 0 52125 1 0 53126 1 0 53127 1 0 53128 1 0 M END