RDKit 3D 119119 0 0 0 0 0 0 0 0999 V2000 11.5969 1.9326 -0.2219 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1563 1.6923 -0.4052 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4048 1.9509 0.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5761 1.1645 -1.6549 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2275 -0.2824 -1.4975 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2271 -0.5894 -0.4326 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9155 0.1280 -0.7753 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8675 -0.1941 0.2674 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3886 0.1210 1.6613 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5664 0.4217 0.0855 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1952 1.2395 1.0085 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6357 0.2507 -0.9670 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0261 -0.6515 -2.0558 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3776 0.9430 -1.0064 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4715 0.7605 0.1294 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5896 1.7359 0.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4254 -0.2551 1.0945 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2641 -1.4391 1.0527 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5059 -0.1656 2.2010 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6165 -1.1431 2.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0723 -1.4533 3.3012 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1311 -1.6824 1.0109 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1469 -2.6319 0.7540 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4709 -2.1493 0.4108 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0290 -1.2365 1.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2044 -2.6841 -0.6925 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4988 -3.6564 -1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5566 -2.4278 -1.0143 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.4192 -3.1446 0.0382 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0443 -1.0848 -1.2604 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3409 -1.0004 -1.1886 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4016 0.1119 -1.5553 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9884 0.2085 -1.7801 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1884 1.3604 -1.6266 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.7898 1.6763 -0.3007 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6111 2.9083 -0.2511 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9696 2.8963 -0.4665 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6660 4.0712 -0.3807 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0127 5.2519 -0.0809 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6694 5.2778 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9427 4.1055 0.0523 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1665 1.3092 -2.7161 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4389 0.2281 -3.5755 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8459 2.4028 -2.8796 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2022 -3.6031 1.9551 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2791 -4.6575 1.7841 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8575 -4.2900 2.0236 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1875 0.0220 3.4946 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8149 -1.1351 4.1578 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 0.8386 4.4311 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4889 2.3908 -1.4641 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9597 3.3659 -0.4648 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1648 2.7823 -2.0751 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9166 1.9510 0.8384 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1477 1.0848 -0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9162 2.8694 -0.7011 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6661 1.7168 -1.9883 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3609 1.2073 -2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2058 -0.8153 -1.3177 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9096 -0.6536 -2.5015 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0864 -1.6954 -0.4343 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6096 -0.2309 0.5458 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1334 1.1902 -0.8491 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6420 -0.2736 -1.7682 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7437 -1.3137 0.2278 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9870 1.0281 1.7124 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9625 -0.7084 2.0989 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4967 0.2793 2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5809 -0.1460 -2.8444 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5894 -1.4751 -1.6239 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0962 -1.0921 -2.4944 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8252 0.4954 -1.9305 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1164 -1.4116 1.7326 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5138 -1.7640 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6268 -2.2957 1.4456 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 0.8357 2.0264 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6621 -1.2925 0.1119 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 -3.3282 -0.0455 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3474 -4.5993 -1.0265 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0940 -3.8506 -2.4879 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5472 -3.2160 -1.9311 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8151 -3.0196 -1.9639 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1906 -2.7396 1.0437 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2758 -4.2241 0.0161 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4992 -2.9374 -0.1491 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3988 0.5201 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7494 0.8778 -2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6133 -0.7825 -2.0926 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4970 2.2161 -1.8696 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4581 0.8607 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0205 1.7884 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4380 1.9290 -0.6966 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7238 4.0908 -0.5436 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5471 6.2048 -0.0085 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1841 6.2355 0.3742 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8941 4.1346 0.2226 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4131 -0.0222 -3.8132 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6551 -0.3187 -3.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 -3.0506 2.8415 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0853 -4.1951 1.2099 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5447 -4.9990 2.7995 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7965 -5.5202 1.2503 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0563 -5.3926 2.1995 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3871 -4.2553 1.0087 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1812 -3.9138 2.7989 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0517 0.7509 3.2645 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5194 -2.1324 3.7763 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9199 -1.0822 4.0901 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6094 -1.0477 5.2574 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6249 0.3473 4.6966 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9198 1.1828 5.3051 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 1.7771 3.8783 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2245 2.3746 -2.3081 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5907 4.3898 -0.8379 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0597 3.5242 -0.4039 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5237 3.3123 0.5443 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6226 1.8437 -2.3376 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3589 3.4055 -2.9781 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5215 3.3796 -1.4305 H 0 0 0 0 0 0 0 0 0 0 0 0 46 45 1 0 45 47 1 0 45 23 1 0 23 22 1 0 22 20 1 0 20 21 2 0 20 19 1 0 19 48 1 0 48 49 1 0 48 50 1 0 19 17 1 0 17 18 1 0 17 15 1 0 15 16 2 0 15 14 1 0 14 51 1 0 51 52 1 0 51 53 1 0 14 12 1 0 12 13 1 0 12 10 1 0 10 11 2 0 10 8 1 0 8 9 1 0 8 7 1 0 7 6 1 0 6 5 1 0 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 26 28 1 0 28 29 1 0 28 30 1 0 30 31 2 0 30 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 35 36 1 0 36 37 2 0 37 38 1 0 38 39 2 0 39 40 1 0 40 41 2 0 34 42 1 0 42 43 1 0 42 44 2 0 41 36 1 0 46100 1 0 46101 1 0 46102 1 0 45 99 1 0 47103 1 0 47104 1 0 47105 1 0 23 78 1 6 22 77 1 0 19 76 1 6 48106 1 0 49107 1 0 49108 1 0 49109 1 0 50110 1 0 50111 1 0 50112 1 0 18 73 1 0 18 74 1 0 18 75 1 0 14 72 1 6 51113 1 0 52114 1 0 52115 1 0 52116 1 0 53117 1 0 53118 1 0 53119 1 0 13 69 1 0 13 70 1 0 13 71 1 0 8 65 1 1 9 66 1 0 9 67 1 0 9 68 1 0 7 63 1 0 7 64 1 0 6 61 1 0 6 62 1 0 5 59 1 0 5 60 1 0 4 57 1 0 4 58 1 0 1 54 1 0 1 55 1 0 1 56 1 0 27 79 1 0 27 80 1 0 27 81 1 0 28 82 1 6 29 83 1 0 29 84 1 0 29 85 1 0 33 86 1 0 33 87 1 0 33 88 1 0 34 89 1 6 35 90 1 0 35 91 1 0 37 92 1 0 38 93 1 0 39 94 1 0 40 95 1 0 41 96 1 0 43 97 1 0 43 98 1 0 M END