RDKit 3D 170176 0 0 0 0 0 0 0 0999 V2000 6.2070 6.0083 -1.4866 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6224 4.7173 -0.9912 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3866 4.9510 -0.1407 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7763 5.7777 1.0467 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7079 3.6353 0.2346 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5776 4.0089 1.0508 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2249 3.7779 0.8719 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6059 3.1629 1.8287 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3466 4.1251 -0.2586 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8675 5.1855 -1.1807 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0624 6.4720 -0.4102 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6024 7.5474 -1.3556 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 7.0104 0.0851 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0506 2.9259 -0.9661 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2276 2.7074 -1.6754 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0936 2.3115 -2.8966 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 2.8644 -1.2279 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1335 4.2696 -1.4458 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9467 4.6280 -0.2510 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8202 6.0778 0.1403 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 3.7655 0.8197 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8661 2.5567 0.1676 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 1.2911 0.7462 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8642 1.2920 1.7842 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1578 -0.0203 0.3309 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.6012 -0.0039 0.1629 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4716 -0.6515 1.0653 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9441 -1.2621 2.0404 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9519 -0.6758 0.9677 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.4768 -0.5307 2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9278 -0.5368 2.4393 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6235 -1.6950 2.6525 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0127 -1.6881 2.7272 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7227 -0.5013 2.5859 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0229 0.6597 2.3715 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6380 0.6405 2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4550 -1.7774 0.2225 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1894 -3.1279 0.6665 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2188 -1.6121 -0.9708 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5217 -0.2549 -1.4877 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6577 -2.5959 -1.6185 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4713 -0.6204 -0.8341 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2168 -1.7038 -1.3509 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7625 -2.9517 -1.6484 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6680 -3.8473 -1.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3366 -3.2551 -1.7533 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7747 -2.4271 -2.9189 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1414 -3.2993 -4.0977 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5657 -4.6269 -3.5782 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0434 -4.6081 -2.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3996 -5.6102 -1.4233 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5672 -6.1908 -2.0424 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -6.0435 -0.0842 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1916 -5.9018 0.2635 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0796 -6.5288 1.6639 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8392 -7.8881 1.5773 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9231 -5.7488 2.2164 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -5.3653 1.0323 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -4.4868 1.0644 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8608 -3.3275 1.6075 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3554 -4.7242 0.5187 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6967 -6.1875 0.3894 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3958 -6.6198 1.6547 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7258 -6.8849 1.3509 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2235 -5.4088 2.5342 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2901 -4.3221 1.5478 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0598 -3.1515 1.6051 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1454 -2.4900 2.7141 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8167 -2.5852 0.4459 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4790 -3.6927 -0.3893 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3342 -4.4529 0.4193 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9093 -1.7809 0.9716 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8772 -0.4017 1.1169 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2900 0.0945 2.2278 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4032 0.5500 0.0923 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1892 0.3023 -1.1686 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6416 0.4875 -1.0234 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5473 -0.4748 -0.6541 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9015 -0.1853 -0.5415 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3790 1.0791 -0.7987 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7195 1.4006 -0.6954 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4909 2.0558 -1.1713 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1507 1.7619 -1.2801 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5685 1.8764 0.6400 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6463 2.8244 1.0464 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5814 3.0513 2.3154 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8692 5.7385 -2.3609 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3944 6.6281 -1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8612 6.5217 -0.7827 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4316 4.0579 -1.8469 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4216 4.2189 -0.3697 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7227 5.5769 -0.7817 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8765 6.2322 1.4843 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3084 5.1859 1.8104 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4285 6.5982 0.6527 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3950 3.0811 -0.6745 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8541 4.5462 1.9408 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5709 4.6089 0.2162 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6959 4.9044 -1.8181 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0153 5.4058 -1.8911 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7374 6.4067 0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0001 8.3978 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3328 7.1319 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7395 7.9328 -1.9496 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0563 6.9334 -0.7172 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5765 6.5587 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1208 8.0972 0.2487 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6611 2.1293 -0.9265 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3130 2.2074 -1.7992 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3273 5.0017 -1.6772 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8156 4.3227 -2.3411 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0255 4.3850 -0.3697 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6266 6.7337 -0.7357 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7807 6.4080 0.5777 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0334 6.2426 0.8946 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5472 4.2545 1.3994 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1701 3.5978 1.5603 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9938 -0.7347 1.1973 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0196 0.4985 -0.6468 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2680 0.2663 0.4286 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1385 0.4921 2.7099 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9751 -1.2235 3.0758 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1120 -2.6544 2.7717 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5007 -2.6342 2.8979 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8035 -0.5661 2.6544 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5621 1.5886 2.2599 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1209 1.5766 2.1278 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5543 -3.1702 1.5623 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6059 -3.6354 -0.1589 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1702 -3.6467 0.8126 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6066 0.3168 -1.7462 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1005 0.3034 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1290 -0.3042 -2.3955 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4773 -1.0410 -0.4901 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2308 0.1213 -1.5893 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7443 -2.9354 -0.8746 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3117 -2.2819 -2.8303 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3546 -1.4966 -3.0387 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9857 -2.8851 -4.6928 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2855 -3.3698 -4.8245 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0362 -5.4001 -4.1781 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6263 -4.8600 -3.6251 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5424 -7.1692 -0.0082 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4665 -4.8623 0.4619 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8303 -6.4599 -0.4094 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0137 -6.2691 2.1985 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2387 -8.1897 2.3127 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3385 -4.8077 2.6767 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4181 -6.3984 2.9185 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5389 -4.1263 -0.3739 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3398 -6.3177 -0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7797 -6.7897 0.2797 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9172 -7.5243 2.1009 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7753 -7.3764 0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0040 -5.3931 3.2861 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1947 -5.4605 2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1232 -2.0398 -0.1935 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7815 -4.2878 -0.9591 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1693 -3.1247 -1.0791 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1917 -4.6363 -0.0564 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7794 -2.3227 1.2695 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3225 0.3015 -0.1045 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8411 0.8850 -2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0190 -0.7687 -1.4431 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2115 -1.4799 -0.4538 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6134 -0.9599 -0.2454 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0522 2.3325 -0.8855 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8725 3.0450 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5151 2.5702 -1.5877 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6102 2.1330 0.7526 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 3 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 9 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 32 33 1 0 33 34 2 0 34 35 1 0 35 36 2 0 29 37 1 0 37 38 1 0 37 39 1 0 39 40 1 0 39 41 2 0 25 42 1 0 42 43 1 0 43 44 1 0 44 45 2 0 44 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 51 52 2 0 51 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 55 57 1 0 57 58 1 0 58 59 1 0 59 60 2 0 59 61 1 0 61 62 1 0 62 63 1 0 63 64 1 0 63 65 1 0 65 66 1 0 66 67 1 0 67 68 2 0 67 69 1 0 69 70 1 0 70 71 1 0 69 72 1 0 72 73 1 0 73 74 2 0 73 75 1 0 75 76 1 0 76 77 1 0 77 78 2 0 78 79 1 0 79 80 2 0 80 81 1 0 80 82 1 0 82 83 2 0 75 84 1 0 84 85 1 0 85 86 2 0 85 5 1 0 22 17 1 0 36 31 1 0 50 46 1 0 58 53 1 0 66 61 1 0 83 77 1 0 1 87 1 0 1 88 1 0 1 89 1 0 2 90 1 0 2 91 1 0 3 92 1 6 4 93 1 0 4 94 1 0 4 95 1 0 5 96 1 6 6 97 1 0 9 98 1 1 10 99 1 0 10100 1 0 11101 1 1 12102 1 0 12103 1 0 12104 1 0 13105 1 0 13106 1 0 13107 1 0 14108 1 0 17109 1 6 18110 1 0 18111 1 0 19112 1 6 20113 1 0 20114 1 0 20115 1 0 21116 1 0 21117 1 0 25118 1 1 26119 1 0 29120 1 6 30121 1 0 30122 1 0 32123 1 0 33124 1 0 34125 1 0 35126 1 0 36127 1 0 38128 1 0 38129 1 0 38130 1 0 40131 1 0 40132 1 0 40133 1 0 42134 1 0 42135 1 0 46136 1 1 47137 1 0 47138 1 0 48139 1 0 48140 1 0 49141 1 0 49142 1 0 53143 1 6 54144 1 0 54145 1 0 55146 1 1 56147 1 0 57148 1 0 57149 1 0 61150 1 6 62151 1 0 62152 1 0 63153 1 1 64154 1 0 65155 1 0 65156 1 0 69157 1 6 70158 1 0 70159 1 0 71160 1 0 72161 1 0 75162 1 6 76163 1 0 76164 1 0 78165 1 0 79166 1 0 81167 1 0 82168 1 0 83169 1 0 84170 1 0 M END