RDKit 3D 122124 0 0 0 0 0 0 0 0999 V2000 -6.1852 2.5352 -2.8474 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9240 1.8445 -3.2664 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9157 1.5708 -2.2117 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7388 0.8910 -2.9128 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3753 0.7360 -1.0344 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.4172 1.4073 -0.3195 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3081 2.6915 0.2128 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2569 3.3525 0.0853 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4593 3.3174 0.9635 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.5428 4.7694 0.7109 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7648 5.3041 0.0548 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6682 4.2459 -0.5254 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8316 3.1319 0.4585 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6022 2.5064 0.8118 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7652 1.6437 1.9746 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2632 0.3590 -0.1621 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8824 1.2452 0.6848 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5357 -0.8657 -0.1306 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9365 -2.0113 -0.8579 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6995 -2.9913 -0.3385 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9130 -3.0083 0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4785 -1.8625 0.3776 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5981 -4.2000 0.7363 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0841 -5.3772 0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8302 -6.5784 1.1221 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7972 -5.6333 -0.0718 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2763 -0.8534 0.6711 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1129 -1.1708 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2352 -1.1611 0.4171 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5630 -1.9768 1.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2616 -1.5467 2.5972 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5903 -2.4578 3.7129 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6336 -0.3531 2.6852 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 -1.5501 -0.6903 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4868 -1.2325 -0.7263 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2322 -1.6480 -1.7248 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6656 -1.2677 -1.8162 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3815 -1.7933 -2.6859 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2485 -0.3192 -0.9450 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6243 0.1185 -0.9543 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9247 1.3791 -1.6457 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3952 1.6701 -1.5931 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2442 1.0721 -2.5249 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 1.3409 -2.5186 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1656 2.2041 -1.6023 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5139 2.5076 -1.5541 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3410 2.8043 -0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9809 2.5237 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3534 -0.1833 0.2902 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8292 0.2944 1.5796 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6468 1.7434 1.8115 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7753 -0.2183 2.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3656 0.5994 3.3796 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9404 -1.5745 2.7592 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6154 -2.4045 -2.6837 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0086 -2.4725 -2.0979 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4435 -1.6770 1.9153 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5812 -1.1381 2.7564 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4648 -3.1392 1.7769 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7949 2.8214 -3.7675 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7954 1.9665 -2.1502 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9446 3.5261 -2.3849 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4693 2.4244 -4.1164 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2787 0.8762 -3.7627 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 2.5650 -1.9033 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1855 1.5985 -3.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1018 0.5048 -2.0721 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1007 0.0199 -3.4737 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8824 -0.1367 -1.5499 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3623 0.9198 -0.1395 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0986 3.2128 2.0534 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4239 5.3217 1.6809 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6054 5.0516 0.1336 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3998 5.8851 0.7899 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5201 6.0714 -0.7255 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6936 4.6666 -0.7175 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2994 3.8954 -1.5128 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4959 2.3561 -0.0078 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2840 3.5621 1.3758 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5532 0.8805 1.7982 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0432 2.2985 2.8435 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8032 1.1549 2.1967 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 -2.4924 -1.3656 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5077 -1.6032 -1.7701 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5552 -4.0737 1.2129 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0619 -7.3019 1.4767 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4784 -6.3201 1.9732 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3803 -7.0922 0.2938 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8648 -5.1505 -1.0938 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6417 -6.7278 -0.2484 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9766 -5.1721 0.4695 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1872 0.1848 1.0371 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -2.1019 -0.7764 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0981 -0.3640 -0.9814 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5851 -0.1145 0.6994 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8649 -2.2494 4.5271 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5028 -3.4833 3.3173 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6456 -2.2656 4.0363 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5730 0.0901 -0.2242 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0906 -0.6745 -1.7067 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 2.2928 -1.3173 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7437 1.2364 -2.7742 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8301 0.3903 -3.2575 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2851 0.8962 -3.2299 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0974 1.9058 -0.9589 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7028 3.4967 0.0848 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3610 3.0196 0.0225 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4153 0.2146 0.2048 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5434 -1.2973 0.4119 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8869 -0.2933 1.8086 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9794 1.9402 2.7185 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6091 2.2416 2.1371 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2678 2.3439 0.9732 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6523 -2.0835 3.5831 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0709 -2.8444 -3.5929 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5338 -1.4337 2.5474 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5069 -0.9899 2.1511 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7677 -1.8129 3.6423 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3515 -0.1520 3.2075 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4728 -3.5155 2.1096 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2402 -3.5584 0.8023 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7641 -3.6704 2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 3 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 5 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 2 3 24 25 1 0 24 26 1 0 18 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 31 33 2 0 29 34 1 0 34 35 2 0 35 36 1 0 36 37 1 0 37 38 2 0 37 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 2 0 43 44 1 0 44 45 2 0 45 46 1 0 45 47 1 0 47 48 2 0 40 49 1 0 49 50 1 0 50 51 1 0 50 52 1 0 52 53 2 0 52 54 1 0 36 55 2 0 55 56 1 0 27 57 1 0 57 58 1 0 57 59 1 0 14 9 1 0 56 34 1 0 48 42 1 0 1 60 1 0 1 61 1 0 1 62 1 0 2 63 1 0 2 64 1 0 3 65 1 1 4 66 1 0 4 67 1 0 4 68 1 0 5 69 1 6 6 70 1 0 9 71 1 1 10 72 1 0 10 73 1 0 11 74 1 0 11 75 1 0 12 76 1 0 12 77 1 0 13 78 1 0 13 79 1 0 15 80 1 0 15 81 1 0 15 82 1 0 19 83 1 0 19 84 1 0 23 85 1 0 25 86 1 0 25 87 1 0 25 88 1 0 26 89 1 0 26 90 1 0 26 91 1 0 27 92 1 1 28 93 1 0 28 94 1 0 29 95 1 1 32 96 1 0 32 97 1 0 32 98 1 0 39 99 1 0 40100 1 6 41101 1 0 41102 1 0 43103 1 0 44104 1 0 46105 1 0 47106 1 0 48107 1 0 49108 1 0 49109 1 0 50110 1 1 51111 1 0 51112 1 0 51113 1 0 54114 1 0 55115 1 0 57116 1 1 58117 1 0 58118 1 0 58119 1 0 59120 1 0 59121 1 0 59122 1 0 M END