RDKit 3D 105114 0 0 0 0 0 0 0 0999 V2000 12.3749 0.1193 -2.3814 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0383 -0.0313 -2.6464 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2348 1.0156 -2.2071 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2617 0.4465 -1.2021 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0497 -0.1774 -1.8491 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7866 -1.3584 -1.1839 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5319 -1.4285 -0.6204 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6784 -2.5652 -1.0687 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6091 -2.7942 -0.0302 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2329 -1.4909 0.6628 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3447 -1.8168 1.6865 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0359 -1.4809 1.3776 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2117 -2.7184 1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1622 -2.5145 2.6760 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5936 -3.6793 2.7827 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6353 -1.3706 2.1843 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0487 -0.2087 1.8879 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5618 0.8480 1.4144 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8604 0.8789 1.1892 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4252 2.0234 0.6885 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7845 2.0740 0.4446 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5706 0.9438 0.7182 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0058 -0.2002 1.2181 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6845 -1.3192 1.5069 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6107 -0.2231 1.4559 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9932 -1.3704 1.9622 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6155 -2.4167 2.2303 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0216 1.0443 0.5239 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5158 2.2656 0.0913 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8623 2.4060 -0.1411 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7358 1.3303 0.0559 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2235 0.1349 0.4823 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8422 -0.0263 0.7248 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4857 -1.2361 1.1306 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1837 -0.9512 0.6499 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8095 -2.0673 1.0352 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5832 -0.7696 0.3783 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.7247 -1.6127 0.6101 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8062 -0.5539 0.8144 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2651 0.6517 0.4572 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0749 0.4272 -0.2451 C 0 0 2 0 0 0 0 0 0 0 0 0 -11.4909 0.1274 -1.6785 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1581 1.5747 -0.1765 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7326 3.4975 -0.1409 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2972 3.3420 -0.1503 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6223 4.3742 0.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2933 4.3821 0.1886 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6421 3.1584 0.4154 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5204 -0.2832 2.1601 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0548 0.9113 1.6476 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2782 -0.8429 1.2409 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5299 -1.3075 0.8791 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8768 -2.5083 1.6534 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3981 -0.4104 -3.1908 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3632 0.8151 -3.8593 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0502 1.5464 -3.6962 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5344 1.6176 -3.4040 C 0 0 2 0 0 0 0 0 0 0 0 0 10.4176 1.7982 -4.4404 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8785 -0.8041 -2.7959 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6527 0.1308 -1.3128 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8256 0.9710 -2.9571 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8788 1.7613 -1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7358 -0.2799 -0.5445 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9346 1.2975 -0.5411 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2189 0.5526 -1.7782 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0132 -0.4745 -0.9524 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2438 -2.2673 -2.0678 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2511 -3.4911 -1.2908 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6893 -3.0828 -0.6304 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7707 -3.6340 0.6353 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6589 -0.9371 -0.1105 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0155 -1.1258 0.3138 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8371 -3.6066 1.8053 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6626 -2.9317 0.5941 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6957 -2.2656 3.5959 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7081 -4.0488 1.8594 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4724 -2.2044 1.8591 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2901 3.3429 -0.4821 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9046 -2.0949 1.3203 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6369 -2.2719 1.4876 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9452 -2.2583 -0.2656 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0869 -0.5730 1.9064 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6871 -0.7939 0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2334 -0.7051 -1.6121 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6024 -0.1392 -2.2647 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9841 1.0094 -2.1092 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2195 2.1526 -1.1454 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5344 2.2564 0.6435 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0910 3.9646 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0580 4.2220 0.6429 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9133 3.3811 -1.2097 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2189 4.7171 -0.8897 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7859 5.1980 0.7568 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7099 -0.4059 3.2407 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5199 1.6505 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2427 -0.4798 1.1766 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7800 -2.3393 2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0886 -2.7977 2.4105 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1028 -3.4240 1.0909 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5033 0.5601 -4.9349 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9132 2.1802 -4.6231 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0839 2.2812 -2.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1910 0.8741 -3.6454 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1455 2.6238 -3.0622 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2154 2.2890 -4.1189 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 14 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 1 0 23 25 2 0 25 26 1 0 26 27 2 0 22 28 1 0 28 29 2 0 29 30 1 0 30 31 2 0 31 32 1 0 32 33 2 0 33 34 1 0 32 35 1 0 35 36 2 0 35 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 6 41 43 1 0 29 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 17 49 1 0 49 50 1 0 10 51 1 0 51 52 1 0 52 53 1 0 5 54 1 0 54 55 1 0 55 56 1 0 55 57 1 0 57 58 1 0 57 3 1 0 52 7 1 0 49 12 1 0 26 16 1 0 33 28 1 0 41 37 1 0 25 19 1 0 43 31 1 0 48 20 1 0 45 21 1 0 1 59 1 0 1 60 1 0 1 61 1 0 3 62 1 1 4 63 1 0 4 64 1 0 5 65 1 6 7 66 1 6 8 67 1 0 8 68 1 0 9 69 1 0 9 70 1 0 10 71 1 6 12 72 1 6 13 73 1 0 13 74 1 0 14 75 1 1 15 76 1 0 24 77 1 0 30 78 1 0 34 79 1 0 38 80 1 0 38 81 1 0 39 82 1 0 39 83 1 0 42 84 1 0 42 85 1 0 42 86 1 0 43 87 1 0 43 88 1 0 44 89 1 0 44 90 1 0 45 91 1 6 47 92 1 0 47 93 1 0 49 94 1 1 50 95 1 0 52 96 1 6 53 97 1 0 53 98 1 0 53 99 1 0 55100 1 6 56101 1 0 56102 1 0 56103 1 0 57104 1 1 58105 1 0 M END