RDKit 3D 108110 0 0 0 0 0 0 0 0999 V2000 -5.7549 -0.1937 1.1212 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5854 -0.3012 0.2033 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6626 -0.8614 -0.9086 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3611 0.2317 0.5761 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2202 0.1585 -0.2546 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8617 1.5264 -0.6625 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8206 1.9186 -1.6719 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4291 2.1851 -2.9625 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4805 2.5846 -3.9318 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2349 2.0880 -3.2789 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7744 2.6308 0.3308 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4052 2.3503 1.7231 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2605 3.1223 0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0444 3.7716 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 4.0604 -0.3463 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 3.3845 0.1212 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6563 4.3582 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8639 2.2136 -0.7215 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4961 2.3914 -1.8966 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5804 1.0241 -0.3253 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8105 0.8356 -0.9856 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0380 0.7034 -2.3248 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4311 0.5178 -2.8215 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0533 0.7459 -3.0733 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0981 1.2616 1.1326 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5931 -0.1242 1.4930 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0989 -0.2205 1.4134 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1001 -0.5628 2.7421 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3863 0.1561 3.8974 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9077 -0.2403 5.2342 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0888 1.1896 3.7676 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0501 -1.0822 0.4241 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9441 -1.2853 -0.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8204 -0.2276 -0.0109 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0025 -0.8542 -1.0453 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9000 -1.8154 -1.6474 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9632 -3.1247 -1.3243 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9070 -3.8527 -1.6904 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9062 -3.7285 -0.5266 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1363 -2.8340 -0.0204 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3055 -1.4799 -0.7012 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2424 -1.6406 -1.6922 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3161 -2.2010 -2.8978 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2736 -2.7391 -3.3158 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5444 -2.2279 -3.7626 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9896 -0.8715 -4.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3052 -3.1839 -4.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1102 -0.6739 0.3580 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5171 -1.4647 1.4072 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1884 -1.3447 2.7057 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4328 -0.4235 3.0254 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6671 -2.2424 3.8007 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1294 -1.8474 5.1345 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -3.6703 3.4263 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8031 -1.1122 1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5884 0.6549 1.8381 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6757 -0.0364 0.5243 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5553 -0.3802 -1.1662 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8943 1.4854 -1.1936 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1266 3.3587 -3.4367 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0637 3.0994 -4.8301 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1642 1.7696 -4.2162 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5105 3.3132 2.3233 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1031 1.6788 2.2683 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3585 2.0772 1.8977 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6986 3.1891 -0.5587 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2313 4.1513 0.8855 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8546 2.4491 1.0547 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7594 4.5127 -0.7496 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4642 5.0233 -0.8826 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4654 3.1881 1.1954 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1985 5.3963 -0.0633 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0296 4.2125 -1.0687 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3531 4.2300 0.7648 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4494 0.4221 -3.9232 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8682 -0.4200 -2.4204 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0774 1.3690 -2.5149 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2673 1.4834 1.8032 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9284 1.9821 1.1303 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3791 -1.1795 1.8948 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3705 -0.3280 0.3326 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6118 0.6505 1.8439 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5976 0.6339 5.8559 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6926 -0.8484 5.7739 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0453 -0.9052 5.1289 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7236 -2.0130 0.9133 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5099 -2.0502 -0.3762 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3586 -0.1717 1.0287 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7601 -0.1756 -1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4077 -4.2685 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4918 -4.5838 -1.1429 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1017 -3.3769 -0.0949 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1067 -2.6009 1.0588 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3671 -2.6647 -3.1566 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1156 -0.2524 -4.4944 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6746 -1.0335 -5.0806 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6111 -0.4223 -3.4104 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2162 -3.4553 -4.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6399 -2.6889 -5.8423 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8427 -4.1452 -4.7763 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4413 0.0955 0.7248 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7723 -2.1510 3.8187 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -2.7532 5.6769 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3467 -1.0647 5.0639 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9355 -1.4109 5.7697 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2482 -3.8596 3.4462 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7512 -3.8312 2.4086 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8962 -4.3334 4.1079 H 0 0 0 0 0 0 0 0 0 0 0 0 53 52 1 0 52 54 1 0 52 50 1 0 50 51 2 0 50 49 1 0 49 48 1 0 48 5 1 0 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 2 0 6 11 1 0 11 12 1 0 11 13 1 0 11 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 16 18 1 0 18 19 2 0 18 20 1 0 20 25 1 0 25 26 1 0 26 27 1 0 26 28 1 1 28 29 1 0 29 30 1 0 29 31 2 0 26 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 2 0 37 39 1 0 39 40 1 0 40 41 1 0 41 42 1 6 42 43 1 0 43 44 2 0 43 45 1 0 45 46 1 0 45 47 1 0 20 21 1 6 21 22 1 0 22 23 1 0 22 24 2 0 41 48 1 0 34 20 1 0 41 35 1 0 53103 1 0 53104 1 0 53105 1 0 52102 1 0 54106 1 0 54107 1 0 54108 1 0 48101 1 1 5 58 1 6 1 55 1 0 1 56 1 0 1 57 1 0 6 59 1 6 9 60 1 0 9 61 1 0 9 62 1 0 12 63 1 0 12 64 1 0 12 65 1 0 13 66 1 0 13 67 1 0 13 68 1 0 14 69 1 0 15 70 1 0 16 71 1 1 17 72 1 0 17 73 1 0 17 74 1 0 25 78 1 0 25 79 1 0 27 80 1 0 27 81 1 0 27 82 1 0 30 83 1 0 30 84 1 0 30 85 1 0 32 86 1 1 33 87 1 0 34 88 1 1 35 89 1 6 39 90 1 0 39 91 1 0 40 92 1 0 40 93 1 0 45 94 1 0 46 95 1 0 46 96 1 0 46 97 1 0 47 98 1 0 47 99 1 0 47100 1 0 23 75 1 0 23 76 1 0 23 77 1 0 M END