RDKit 3D 101100 0 0 0 0 0 0 0 0999 V2000 12.5633 -1.4303 2.2455 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6478 -1.5479 0.7629 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0096 -1.3802 0.1659 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6184 -1.7706 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2295 -1.9373 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2473 -0.9119 -0.1794 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1677 -0.8336 -1.6347 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3746 -0.3518 -2.4033 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1149 -1.0785 -2.3329 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7935 -1.4731 -1.7692 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7809 -0.4996 -2.4265 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4360 -0.8173 -1.9714 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9010 -2.2460 -2.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6667 -0.0156 -1.3314 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9515 1.3417 -0.9128 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9269 1.9462 -0.2894 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8885 3.2701 0.2571 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0567 4.1455 0.2152 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7262 3.7253 0.7983 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6264 2.8201 0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5463 2.7210 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5076 3.4735 1.8561 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7385 2.9299 1.9295 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9214 1.6428 1.2131 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8241 3.5831 2.7041 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9888 3.0116 2.6492 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2618 3.3109 3.2408 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2512 2.3623 2.9074 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6062 2.5690 3.4039 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7459 1.1384 2.4157 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0879 0.0644 1.8961 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3924 -0.4756 1.4978 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3850 -1.6834 0.9691 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1440 -2.4333 0.7847 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6907 -2.2714 0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8131 -2.4796 -0.8457 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6626 -1.1952 -1.6174 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9505 -1.4870 -3.0793 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3734 -2.0078 -3.1973 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9787 -2.3266 -3.7911 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9722 -0.2182 -3.7099 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9395 -2.2356 2.6868 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5939 -1.5524 2.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1952 -0.4046 2.4748 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7964 -1.8636 0.7748 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0140 -1.7075 -0.8932 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2267 -0.2736 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8624 -1.8619 -1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1549 -1.8182 1.4881 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9086 -2.9674 0.1379 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5187 0.1148 0.1842 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2912 -1.1365 0.3283 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0447 0.1940 -1.7223 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8291 -1.1055 -3.0448 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0261 0.4621 -3.1278 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1232 -1.0107 -3.4376 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6866 -1.2794 -0.6877 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4963 -2.4994 -1.9556 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0569 0.5462 -2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8904 -0.6653 -3.5361 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1380 -2.8590 -1.3163 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3709 -2.6748 -3.0907 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8071 -2.1451 -2.3098 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6659 -0.3916 -1.0694 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8922 1.7702 -1.1003 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0749 1.2252 -0.1984 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5662 4.0989 -0.8023 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7699 3.8876 1.0086 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7904 5.2238 0.3176 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6916 4.6970 1.2567 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8896 2.0402 -0.1382 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0091 1.6782 0.7182 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2908 4.3897 2.3167 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3268 0.8410 1.7167 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9601 1.3089 1.2269 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 1.7586 0.1211 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6358 4.4672 3.2539 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0724 2.1766 1.8982 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5278 4.1013 3.8849 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6359 2.3619 4.4961 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9385 3.6340 3.2309 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3016 1.9305 2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5928 1.0286 2.7702 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2580 -0.7051 1.6539 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3017 0.0888 1.6105 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3865 -1.9504 0.1181 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3942 -3.4481 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6775 -2.6668 1.8006 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5553 -1.7103 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7821 -3.2974 1.1357 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7786 -2.9755 -1.0372 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9710 -3.1667 -1.1398 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3937 -0.4644 -1.2383 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6185 -0.8312 -1.4887 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4072 -3.1043 -3.1027 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9765 -1.4992 -2.3693 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7804 -1.7205 -4.1744 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3488 -1.7340 -4.5301 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3338 -2.9792 -3.1888 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5599 -3.0099 -4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7025 0.5057 -3.0755 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 3 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 2 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 12 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 17 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 23 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 28 29 1 0 28 30 1 0 30 31 2 0 31 32 1 0 32 33 2 0 33 34 1 0 33 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 38 40 1 0 38 41 1 0 1 42 1 0 1 43 1 0 1 44 1 0 3 45 1 0 3 46 1 0 3 47 1 0 4 48 1 0 5 49 1 0 5 50 1 0 6 51 1 0 6 52 1 0 8 53 1 0 8 54 1 0 8 55 1 0 9 56 1 0 10 57 1 0 10 58 1 0 11 59 1 0 11 60 1 0 13 61 1 0 13 62 1 0 13 63 1 0 14 64 1 0 15 65 1 0 16 66 1 0 18 67 1 0 18 68 1 0 18 69 1 0 19 70 1 0 20 71 1 0 21 72 1 0 22 73 1 0 24 74 1 0 24 75 1 0 24 76 1 0 25 77 1 0 26 78 1 0 27 79 1 0 29 80 1 0 29 81 1 0 29 82 1 0 30 83 1 0 31 84 1 0 32 85 1 0 34 86 1 0 34 87 1 0 34 88 1 0 35 89 1 0 35 90 1 0 36 91 1 0 36 92 1 0 37 93 1 0 37 94 1 0 39 95 1 0 39 96 1 0 39 97 1 0 40 98 1 0 40 99 1 0 40100 1 0 41101 1 0 M END