RDKit 3D 98103 0 0 0 0 0 0 0 0999 V2000 1.1800 6.0592 0.0605 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2076 6.0290 -1.3234 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4281 5.2172 -2.0956 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4847 4.2744 -1.6828 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 3.5030 -2.5058 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1801 2.4618 -2.1417 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2815 2.4107 -2.8990 O 0 0 0 0 0 3 0 0 0 0 0 0 -4.2252 1.5303 -2.7098 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3480 1.5108 -3.5139 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3331 0.5727 -3.3008 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4648 0.5796 -4.1366 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2416 -0.3532 -2.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0856 -0.3408 -1.4759 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9298 -1.1931 -0.5269 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7629 -2.0389 0.4245 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.3535 -3.3421 -0.0796 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2435 -4.2311 0.9617 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3953 -5.4000 0.5117 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1274 -4.9638 0.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6455 -4.8084 1.2433 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.7662 -5.2901 2.5135 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6086 -3.7007 0.8999 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.9374 -3.7343 -0.4532 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9785 -2.3812 1.2878 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.9030 -1.3319 1.2617 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0759 0.6289 -1.6981 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9743 0.6252 -0.8863 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9395 1.5952 -1.1017 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 1.5591 -0.3171 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1938 1.6273 0.3765 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8557 0.3589 0.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1206 0.5239 0.8769 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0722 -0.6245 0.5482 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2914 -0.2387 1.1108 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3205 -1.1200 0.9506 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8273 -1.4763 2.2032 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7857 -2.4596 2.1720 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4047 -2.5174 3.5659 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8817 -2.2749 1.1801 C 0 0 2 0 0 0 0 0 0 0 0 0 9.0589 -1.8523 1.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5583 -1.4276 -0.0025 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7464 -0.6912 -0.2806 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4729 -0.4212 0.2171 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0413 0.0930 -1.0096 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0212 0.5610 2.3840 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1110 1.2376 2.9441 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7217 1.1726 2.7813 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8812 1.7472 4.0381 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2041 2.1823 1.7844 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0156 3.3079 1.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0792 3.6898 -3.8899 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1974 4.5964 -4.3729 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0554 4.7519 -5.7681 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5359 5.3396 -3.4961 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4555 6.2844 -3.9893 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1519 5.8610 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3501 5.4362 0.4342 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9067 7.1242 0.3625 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 4.1416 -0.6149 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3920 2.2518 -4.2875 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2318 1.1629 -3.7933 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9782 -1.1140 -2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8880 -1.8172 1.1257 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8111 -3.8161 1.8854 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8940 -5.9433 -0.3262 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3014 -6.1417 1.3647 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4844 -5.3010 0.7883 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8032 -5.6520 0.5234 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6846 -5.2319 2.8813 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5330 -3.8001 1.5257 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2001 -4.6562 -0.7016 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6251 -2.4736 2.3306 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4679 -0.5100 0.9316 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8285 -0.0591 -0.0824 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9876 2.2715 -0.1639 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6552 1.4383 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6696 -1.5586 0.9518 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1829 -0.6545 -0.5614 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0297 -2.0419 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2373 -3.4424 2.0195 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8140 -3.5358 3.6541 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2308 -1.7784 3.5741 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6340 -2.3048 4.3414 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1371 -3.3088 0.7822 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8412 -2.2564 1.3703 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3645 -1.9870 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0187 -0.7410 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8557 0.3891 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3831 -0.5497 -1.3641 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0226 -0.5184 2.7255 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3817 0.7364 3.7611 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0288 0.3499 2.8974 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3181 2.6458 3.8858 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8112 2.4632 2.0644 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4965 3.4126 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6632 3.1012 -4.5804 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5972 4.2042 -6.4124 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5443 6.3864 -4.9988 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 51 2 0 51 52 1 0 52 53 1 0 52 54 2 0 54 55 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 10 12 2 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 17 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 13 26 2 0 26 27 1 0 27 28 2 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 37 39 1 0 39 40 1 0 39 41 1 0 41 42 1 0 41 43 1 0 43 44 1 0 32 45 1 0 45 46 1 0 45 47 1 0 47 48 1 0 47 49 1 0 49 50 1 0 54 3 1 0 28 6 1 0 49 30 1 0 26 8 1 0 43 35 1 0 24 15 1 0 1 56 1 0 1 57 1 0 1 58 1 0 4 59 1 0 51 96 1 0 53 97 1 0 55 98 1 0 9 60 1 0 11 61 1 0 12 62 1 0 15 63 1 1 17 64 1 1 18 65 1 0 18 66 1 0 19 67 1 0 20 68 1 6 21 69 1 0 22 70 1 1 23 71 1 0 24 72 1 1 25 73 1 0 27 74 1 0 30 75 1 6 32 76 1 6 33 77 1 0 33 78 1 0 35 79 1 6 37 80 1 6 38 81 1 0 38 82 1 0 38 83 1 0 39 84 1 6 40 85 1 0 41 86 1 6 42 87 1 0 43 88 1 1 44 89 1 0 45 90 1 1 46 91 1 0 47 92 1 1 48 93 1 0 49 94 1 1 50 95 1 0 M CHG 1 7 1 M END