RDKit 3D 118119 0 0 0 0 0 0 0 0999 V2000 5.1132 -3.6888 -2.9403 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8335 -2.3926 -2.7541 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2386 -1.3147 -2.1718 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9061 -1.4822 -1.7585 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7453 -0.7154 -1.8667 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9157 -0.6094 -0.8811 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3236 0.0344 -3.0573 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4325 0.9535 -3.5068 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0444 0.6748 -2.9853 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5915 1.8624 -2.4056 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3112 2.8573 -3.2398 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3397 2.2677 -1.0118 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5810 1.3845 -0.2854 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9851 1.5185 -0.4473 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3765 2.4380 -1.2656 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0295 0.7432 0.1945 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5080 1.2301 1.5084 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0062 2.6074 1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2621 3.0483 1.2919 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6099 4.3942 1.4302 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7183 5.3269 1.8474 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0098 6.6706 2.0046 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4225 4.9184 2.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0976 3.5976 2.0025 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1710 0.4205 -0.6651 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5449 -0.9219 -0.7037 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9210 -1.7867 0.0226 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6421 -1.5456 -1.5334 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.1991 -2.6069 -0.8749 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7486 -3.6782 -0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0212 -4.7704 0.0132 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0922 -3.8071 0.3032 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1899 -2.8110 0.0943 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4159 -4.9130 0.9723 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8191 -5.0284 1.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5792 -0.5495 -2.1280 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.6328 -1.2438 -2.9717 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2855 0.2352 -1.0519 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4381 2.8414 -0.2197 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8865 3.1261 1.1978 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6273 2.2358 -0.0921 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7354 2.1246 0.6345 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6248 2.9816 0.9056 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0712 0.7602 1.2879 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9433 0.3421 2.1289 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9343 -0.9259 2.8378 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1072 -1.3728 4.0435 S 0 0 0 0 0 4 0 0 0 0 0 0 5.8041 -1.5200 3.5875 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6660 -2.4989 4.9527 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3353 0.9528 1.9887 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6175 0.8897 1.4875 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5412 1.2941 2.3175 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1654 0.4528 0.1988 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7762 -0.9312 0.2691 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9077 -0.9928 1.2602 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0611 -0.1410 0.9459 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2036 0.5204 -0.0856 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0968 -0.0607 1.8862 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3907 0.6916 -0.9775 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0918 -0.1556 -2.0551 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6889 0.1465 -3.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -3.5868 -3.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5622 -4.2450 -3.7809 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3021 -4.3387 -2.0262 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8548 -2.3752 -3.1217 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 -2.4242 -1.2374 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2469 -0.7738 -3.8578 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 1.4279 -2.6264 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9944 1.7956 -4.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1901 0.4064 -4.0719 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 0.1285 -3.5154 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3997 3.1899 -1.1155 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 0.6635 0.3436 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5506 -0.2935 0.4223 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3297 0.5550 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6879 1.0886 2.2487 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9950 2.3448 0.9593 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6155 4.6774 1.1891 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9249 7.3909 1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6987 5.6550 2.4729 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 3.2632 2.2324 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6627 1.1585 -1.2153 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0215 -1.9026 -2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0104 -3.2582 -0.9213 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0431 -1.9829 0.7895 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1869 -3.2714 0.3137 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1763 -2.4200 -0.9445 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6850 -5.7014 1.1189 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0308 -4.1289 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4838 -5.2159 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8191 -5.9737 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0167 0.1543 -2.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6602 -0.8836 -2.6843 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5067 -1.0265 -4.0619 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6348 -2.3298 -2.7493 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6447 0.4128 -0.1819 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6628 1.1883 -1.5238 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2062 -0.3036 -0.7697 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6133 3.9177 -0.5989 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1641 3.9593 1.0749 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3276 2.2532 1.5927 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6962 3.4698 1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2697 0.0908 0.4472 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 0.4970 1.5968 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8442 1.1640 2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9693 -1.7730 2.0272 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8747 -1.0945 3.2746 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2733 -2.4243 4.1205 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4581 -0.6852 3.9094 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9389 -1.7009 2.4765 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1866 1.1885 3.0251 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0810 1.1304 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0639 -1.7385 0.4302 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2844 -1.0435 -0.7515 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5640 -0.8551 2.3125 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3003 -2.0595 1.2448 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4219 0.8782 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9984 1.6826 -1.0498 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 21 23 1 0 23 24 2 0 16 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 28 29 1 0 29 30 1 0 30 31 2 0 30 32 1 0 32 33 1 0 32 34 2 0 34 35 1 0 28 36 1 0 36 37 1 0 36 38 1 0 12 39 1 0 39 40 1 0 39 41 1 0 41 42 1 0 42 43 2 0 42 44 1 0 44 45 1 0 45 46 1 0 47 46 1 6 47 48 1 0 47 49 2 0 44 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 56 57 2 0 56 58 1 0 53 59 1 0 59 60 1 0 60 61 2 0 60 3 1 0 24 18 1 0 1 62 1 0 1 63 1 0 1 64 1 0 2 65 1 0 4 66 1 0 7 67 1 6 8 68 1 0 8 69 1 0 8 70 1 0 9 71 1 0 12 72 1 6 13 73 1 0 16 74 1 1 17 75 1 0 17 76 1 0 19 77 1 0 20 78 1 0 22 79 1 0 23 80 1 0 24 81 1 0 25 82 1 0 28 83 1 6 29 84 1 0 33 85 1 0 33 86 1 0 33 87 1 0 34 88 1 0 35 89 1 0 35 90 1 0 35 91 1 0 36 92 1 6 37 93 1 0 37 94 1 0 37 95 1 0 38 96 1 0 38 97 1 0 38 98 1 0 39 99 1 6 40100 1 0 40101 1 0 40102 1 0 44103 1 6 45104 1 0 45105 1 0 46106 1 0 46107 1 0 48108 1 0 48109 1 0 48110 1 0 50111 1 0 53112 1 6 54113 1 0 54114 1 0 55115 1 0 55116 1 0 58117 1 0 59118 1 0 M END