RDKit 3D 159167 0 0 0 0 0 0 0 0999 V2000 -14.1960 0.3638 2.8229 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.0811 0.5731 1.9587 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3749 0.8221 2.3544 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.7270 0.5513 0.5359 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2597 0.3206 0.4019 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7297 0.1483 -0.7448 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.4125 0.2830 1.5081 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0533 0.0677 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2615 0.0551 2.6289 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.9815 -0.1620 2.2957 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0353 0.8063 2.3174 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.9225 1.4896 1.1839 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3784 1.8350 0.0527 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9308 2.9766 -0.6003 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4649 3.4709 -1.7821 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9966 4.5714 -2.4131 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0677 5.2296 -1.8379 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4897 5.0282 -3.5998 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4191 4.3617 -4.1677 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9242 4.8488 -5.3799 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8888 3.2666 -3.5394 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3892 2.7803 -2.3274 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8819 1.7423 -1.7425 O 0 0 0 0 0 3 0 0 0 0 0 0 -6.3334 1.2297 -0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6033 0.0508 -0.1317 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1175 -1.1060 0.3566 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4202 -2.2081 0.7494 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9045 -3.3954 1.2338 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2599 -3.7041 1.2514 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.8135 -3.9372 2.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1902 -3.8377 2.3930 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.7966 -4.1238 3.7545 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4522 -5.3940 4.2039 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8181 -4.7366 1.3820 C 0 0 1 0 0 0 0 0 0 0 0 0 -11.0330 -4.1163 0.9845 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0112 -4.9331 0.1219 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.4283 -6.1216 -0.4927 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5301 -4.9856 0.4409 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.2385 -6.1248 1.1486 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0198 -2.1154 0.6323 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2451 -3.1953 1.0112 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4172 -0.9563 0.1413 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0210 -0.9785 0.0751 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2008 0.1367 -0.0471 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6308 0.3087 -1.3154 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2504 -0.9198 -1.8446 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5926 -0.6760 -3.0686 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8206 -0.0869 -2.8672 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 1.0851 -2.3244 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3551 1.8720 -1.8895 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6262 1.4478 -2.2321 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5553 0.6602 -2.7241 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9840 0.8723 -2.7029 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8222 0.0030 -3.3936 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1938 0.1298 -3.3515 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8058 1.1237 -2.6228 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1673 1.3226 -2.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1795 0.6365 -3.1808 C 0 0 2 0 0 0 0 0 0 0 0 0 11.7123 -0.3728 -2.3675 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8685 0.0032 -1.6944 C 0 0 2 0 0 0 0 0 0 0 0 0 13.0138 -0.8562 -0.4792 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1113 -0.5707 0.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4127 -0.6344 -0.1307 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6275 -0.9654 -1.3128 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5197 -0.3059 0.8011 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7808 -0.3353 0.4414 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9021 -0.0252 1.3066 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7024 0.3321 2.6156 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7643 0.6402 3.4776 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0570 0.5825 2.9955 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1260 0.8843 3.8441 O 0 0 0 0 0 0 0 0 0 0 0 0 21.2534 0.2286 1.6918 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2072 -0.0783 0.8306 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7176 1.4451 -1.2688 C 0 0 1 0 0 0 0 0 0 0 0 0 13.7220 1.7274 -0.3413 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9124 2.3013 -2.5095 C 0 0 2 0 0 0 0 0 0 0 0 0 12.4420 3.5806 -2.3414 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2718 1.5625 -3.6755 C 0 0 1 0 0 0 0 0 0 0 0 0 13.1761 0.8607 -4.4224 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9824 1.9837 -1.9408 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5884 1.8723 -1.9723 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5318 -1.7166 -0.8143 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6393 -2.2451 -1.4555 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0181 -0.8668 0.3359 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4167 -1.7112 1.3814 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0188 0.0578 0.9044 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4704 1.3339 1.1118 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2012 0.0988 -0.2296 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2717 1.8234 3.4572 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.0855 1.1315 4.6446 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6707 2.3351 3.4046 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.9460 3.1248 2.2893 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.6115 1.1718 3.5354 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.5193 0.7363 4.8822 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.7706 1.7609 2.2317 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9278 1.5449 0.0388 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3161 -0.1852 -0.0535 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8048 -0.9136 0.8164 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5472 0.8239 0.6811 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6581 -0.9063 3.1293 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0225 0.3076 2.5539 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7770 3.4986 -0.1486 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4678 6.0323 -2.2933 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8906 5.8965 -4.1242 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3204 4.4894 -6.2386 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0572 2.7490 -3.9773 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2147 -1.1551 0.4343 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8672 -2.9288 0.7836 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4415 -2.7623 2.1936 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9089 -4.0660 3.7175 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4882 -3.3928 4.5269 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5406 -5.6684 3.9871 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1139 -5.6969 1.8593 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6828 -4.0821 1.7022 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2431 -4.1310 -0.6043 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4228 -6.1155 -0.5342 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9679 -4.8739 -0.5016 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5095 -5.9775 1.7719 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -4.0347 1.3617 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7611 1.0499 0.1546 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1428 -1.4936 -2.1351 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7486 -1.6567 -3.6299 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0303 -0.0704 -3.8288 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9242 2.3615 -1.7617 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1689 -0.2565 -3.1947 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3740 -0.7901 -3.9721 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8460 -0.5537 -3.8938 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7542 0.1029 -4.0479 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7573 -0.0381 -2.3641 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0696 -0.6960 0.1238 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9726 -1.9150 -0.8354 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2444 -0.0406 1.8037 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0110 -0.6122 -0.6041 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7132 0.3905 3.0244 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6048 0.9161 4.5022 H 0 0 0 0 0 0 0 0 0 0 0 0 23.0780 0.8511 3.5294 H 0 0 0 0 0 0 0 0 0 0 0 0 22.2710 0.1845 1.2982 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3480 -0.3639 -0.1983 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7474 1.6493 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3484 1.5900 0.5913 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0025 2.3437 -2.7166 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6382 3.6741 -1.7867 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7892 2.3245 -4.3153 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2288 1.2067 -5.3486 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4385 2.7830 -1.3555 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9885 2.5714 -1.4202 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -2.5569 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 -2.5671 -0.8716 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9307 -0.2833 0.0954 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6581 -2.5994 1.0312 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4579 -0.3586 1.8577 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3381 1.9313 1.0636 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7341 0.9985 -0.6084 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5096 2.6272 3.4083 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9780 1.7556 5.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8261 2.9741 4.2995 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9312 3.2578 2.2082 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6509 1.4925 3.3092 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3561 0.9112 5.3822 H 0 0 0 0 0 0 0 0 0 0 0 0 33 32 1 0 32 31 1 0 31 30 1 0 30 29 1 0 29 28 1 0 28 27 1 0 27 26 2 0 26 25 1 0 25 88 2 0 88 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 2 0 49 51 1 0 51 52 2 0 52 53 1 0 53 54 2 0 54 55 1 0 55 56 2 0 56 57 1 0 57 58 1 0 58 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 62 63 1 0 63 64 2 0 63 65 1 0 65 66 2 0 66 67 1 0 67 68 2 0 68 69 1 0 69 70 2 0 70 71 1 0 70 72 1 0 72 73 2 0 60 74 1 0 74 75 1 0 74 76 1 0 76 77 1 0 76 78 1 0 78 79 1 0 56 80 1 0 80 81 2 0 46 82 1 0 82 83 1 0 82 84 1 0 84 85 1 0 84 86 1 0 86 87 1 0 42 40 2 0 40 41 1 0 25 24 1 0 24 23 2 0 23 22 1 0 22 21 2 0 21 19 1 0 19 20 1 0 19 18 2 0 18 16 1 0 16 17 1 0 16 15 2 0 15 14 1 0 14 13 2 0 13 12 1 0 12 11 1 0 11 10 1 0 10 9 1 0 9 8 1 0 8 7 1 0 7 5 1 0 5 6 2 0 5 4 1 0 4 2 1 0 2 3 1 0 2 1 2 0 9 93 1 0 93 94 1 0 93 91 1 0 91 92 1 0 91 89 1 0 89 90 1 0 29 38 1 0 38 39 1 0 38 36 1 0 36 37 1 0 36 34 1 0 34 35 1 0 34 31 1 0 40 27 1 0 13 24 1 0 89 11 1 0 86 44 1 0 15 22 1 0 81 53 1 0 78 58 1 0 73 67 1 0 33112 1 0 32110 1 0 32111 1 0 31109 1 6 29108 1 6 26107 1 0 88153 1 0 44120 1 1 46121 1 6 47122 1 0 47123 1 0 51124 1 0 52125 1 0 54126 1 0 55127 1 0 58128 1 6 60129 1 6 61130 1 0 61131 1 0 65132 1 0 66133 1 0 68134 1 0 69135 1 0 71136 1 0 72137 1 0 73138 1 0 74139 1 1 75140 1 0 76141 1 6 77142 1 0 78143 1 6 79144 1 0 80145 1 0 81146 1 0 82147 1 1 83148 1 0 84149 1 6 85150 1 0 86151 1 1 87152 1 0 41119 1 0 21106 1 0 20105 1 0 18104 1 0 17103 1 0 14102 1 0 11101 1 1 9100 1 1 8 98 1 0 8 99 1 0 4 96 1 0 4 97 1 0 3 95 1 0 93158 1 6 94159 1 0 91156 1 1 92157 1 0 89154 1 6 90155 1 0 38117 1 6 39118 1 0 36115 1 6 37116 1 0 34113 1 1 35114 1 0 M CHG 1 23 1 M END