TITL 0SRC128 in C2/c OpenBabel09240911033D 95 99 0 0 0 0 0 0 0 0999 V2000 16.2439 6.6344 11.2961 C 0 0 0 0 0 15.7113 4.5121 10.8507 C 0 0 0 0 0 15.3708 3.1986 11.0688 C 0 0 0 0 0 15.2119 2.8962 11.9552 H 0 0 0 0 0 15.2567 2.3122 10.0144 C 0 0 0 0 0 15.0236 1.4053 10.1748 H 0 0 0 0 0 15.4853 2.7569 8.7191 C 0 0 0 0 0 15.8002 4.0864 8.4499 C 0 0 0 0 0 15.9293 4.3915 7.5596 H 0 0 0 0 0 15.9185 4.9491 9.5302 C 0 0 0 0 0 13.9787 8.8165 15.8733 C 0 0 0 0 0 13.1194 8.4475 15.5804 H 0 0 0 0 0 14.2851 9.4848 15.2253 H 0 0 0 0 0 13.8708 9.2383 16.7513 H 0 0 0 0 0 16.5645 8.4647 16.5725 C 0 0 0 0 0 17.3413 7.8789 16.6903 H 0 0 0 0 0 16.3354 8.8798 17.4302 H 0 0 0 0 0 16.7780 9.1627 15.9184 H 0 0 0 0 0 19.7319 6.1941 14.9018 C 0 0 0 0 0 19.4825 7.1159 14.6816 H 0 0 0 0 0 20.1979 5.7909 14.1398 H 0 0 0 0 0 20.3227 6.1935 15.6836 H 0 0 0 0 0 19.0020 3.6774 15.5645 C 0 0 0 0 0 18.3053 3.0254 15.7880 H 0 0 0 0 0 19.6333 3.7495 16.3106 H 0 0 0 0 0 19.4788 3.3833 14.7604 H 0 0 0 0 0 12.1733 6.7721 12.5395 C 0 0 0 0 0 11.2751 7.8107 12.7725 C 0 0 0 0 0 10.8533 7.8978 13.6193 H 0 0 0 0 0 11.0026 8.7126 11.7634 C 0 0 0 0 0 10.3746 9.4085 11.9182 H 0 0 0 0 0 11.6233 8.6237 10.5356 C 0 0 0 0 0 11.4357 9.2576 9.8533 H 0 0 0 0 0 12.5237 7.5969 10.3123 C 0 0 0 0 0 12.9637 7.5261 9.4734 H 0 0 0 0 0 12.7807 6.6852 11.2962 C 0 0 0 0 0 13.3891 5.9759 11.1249 H 0 0 0 0 0 11.0674 4.3841 13.5931 C 0 0 0 0 0 11.0305 3.3763 12.6279 C 0 0 0 0 0 11.7868 3.2365 12.0702 H 0 0 0 0 0 9.9089 2.5748 12.4685 C 0 0 0 0 0 9.9142 1.8667 11.8352 H 0 0 0 0 0 8.8084 2.8070 13.2192 C 0 0 0 0 0 8.0383 2.2651 13.0936 H 0 0 0 0 0 8.7783 3.8025 14.1537 C 0 0 0 0 0 7.9979 3.9534 14.6739 H 0 0 0 0 0 9.9320 4.6071 14.3341 C 0 0 0 0 0 9.9197 5.3084 14.9748 H 0 0 0 0 0 14.4052 1.8732 14.6990 C 0 0 0 0 0 13.1960 1.4297 14.1846 C 0 0 0 0 0 12.3835 1.7922 14.5179 H 0 0 0 0 0 13.1576 0.4730 13.1997 C 0 0 0 0 0 12.3176 0.1980 12.8515 H 0 0 0 0 0 14.2911 -0.0866 12.7142 C 0 0 0 0 0 14.2517 -0.7578 12.0430 H 0 0 0 0 0 15.5210 0.3445 13.2217 C 0 0 0 0 0 16.3239 -0.0213 12.8696 H 0 0 0 0 0 15.5908 1.2856 14.2185 C 0 0 0 0 0 16.4319 1.5383 14.5809 H 0 0 0 0 0 15.1983 2.3587 17.3851 C 0 0 0 0 0 14.6421 1.1741 17.8381 C 0 0 0 0 0 13.8657 0.8394 17.4049 H 0 0 0 0 0 15.1746 0.4566 18.9002 C 0 0 0 0 0 14.7699 -0.3504 19.1958 H 0 0 0 0 0 16.2946 0.9422 19.5075 C 0 0 0 0 0 16.6823 0.4588 20.2276 H 0 0 0 0 0 16.8819 2.1398 19.0882 C 0 0 0 0 0 17.6552 2.4737 19.5275 H 0 0 0 0 0 16.3267 2.8348 18.0271 C 0 0 0 0 0 16.7251 3.6471 17.7372 H 0 0 0 0 0 15.9034 5.4913 11.8172 N 0 0 0 0 0 16.4697 7.7544 11.9565 N 0 0 0 0 0 16.3933 7.7714 12.8331 H 0 0 0 0 0 16.6966 8.4842 11.5204 H 0 0 0 0 0 19.0081 11.5870 13.4964 F 0 0 0 0 0 18.4403 9.4523 14.0120 F 0 0 0 0 0 20.5350 9.9147 13.3023 F 0 0 0 0 0 20.1961 9.3647 15.4397 F 0 0 0 0 0 20.7622 11.4639 14.9190 F 0 0 0 0 0 18.6666 11.0191 15.6418 F 0 0 0 0 0 12.4736 5.4813 13.7763 P 0 0 0 0 0 14.5115 3.1831 15.9390 P 0 0 0 0 0 19.6022 10.4681 14.4593 P 0 0 0 0 0 16.3455 6.6479 9.5341 S 0 0 0 0 0 15.1800 7.5056 15.9877 S 0 0 0 0 0 18.2613 5.2509 15.2666 S 0 0 0 0 0 15.3307 1.6440 7.3976 Cl 0 0 0 0 0 15.6259 5.0865 13.7521 Cu 0 0 0 0 0 12.4719 5.3572 16.9140 Cu 0 0 0 0 0 15.5236 7.1564 14.5516 O 0 0 0 0 0 17.6024 5.1077 13.8791 O 0 0 0 0 0 13.7268 4.7369 13.3969 O 0 0 0 0 0 12.3879 6.1288 15.1482 O 0 0 0 0 0 13.1072 3.6623 16.2257 O 0 0 0 0 0 15.5162 4.2298 15.5122 O 0 0 0 0 0 84 1 1 0 0 0 1 71 2 0 0 0 1 72 1 0 0 0 10 2 2 0 0 0 2 3 1 0 0 0 2 71 1 0 0 0 5 3 2 0 0 0 3 4 1 0 0 0 7 5 1 0 0 0 5 6 1 0 0 0 87 7 1 0 0 0 8 7 2 0 0 0 9 8 1 0 0 0 8 10 1 0 0 0 10 84 1 0 0 0 13 11 1 0 0 0 12 11 1 0 0 0 11 85 1 0 0 0 11 14 1 0 0 0 18 15 1 0 0 0 85 15 1 0 0 0 15 16 1 0 0 0 15 17 1 0 0 0 21 19 1 0 0 0 20 19 1 0 0 0 19 86 1 0 0 0 19 22 1 0 0 0 26 23 1 0 0 0 86 23 1 0 0 0 23 24 1 0 0 0 23 25 1 0 0 0 36 27 2 0 0 0 27 28 1 0 0 0 27 81 1 0 0 0 30 28 2 0 0 0 28 29 1 0 0 0 32 30 1 0 0 0 30 31 1 0 0 0 33 32 1 0 0 0 34 32 2 0 0 0 35 34 1 0 0 0 34 36 1 0 0 0 37 36 1 0 0 0 39 38 2 0 0 0 38 81 1 0 0 0 38 47 1 0 0 0 40 39 1 0 0 0 41 39 1 0 0 0 42 41 1 0 0 0 41 43 2 0 0 0 44 43 1 0 0 0 43 45 1 0 0 0 45 47 2 0 0 0 45 46 1 0 0 0 47 48 1 0 0 0 50 49 2 0 0 0 58 49 1 0 0 0 49 82 1 0 0 0 52 50 1 0 0 0 50 51 1 0 0 0 54 52 2 0 0 0 53 52 1 0 0 0 55 54 1 0 0 0 54 56 1 0 0 0 57 56 1 0 0 0 56 58 2 0 0 0 58 59 1 0 0 0 82 60 1 0 0 0 60 61 2 0 0 0 60 69 1 0 0 0 62 61 1 0 0 0 61 63 1 0 0 0 63 64 1 0 0 0 63 65 2 0 0 0 67 65 1 0 0 0 65 66 1 0 0 0 69 67 2 0 0 0 67 68 1 0 0 0 70 69 1 0 0 0 71 88 1 0 0 0 74 72 1 0 0 0 72 73 1 0 0 0 75 83 1 0 0 0 77 83 1 0 0 0 83 78 1 0 0 0 83 79 1 0 0 0 83 80 1 0 0 0 92 81 1 0 0 0 81 93 1 0 0 0 95 82 1 0 0 0 82 94 1 0 0 0 90 85 1 0 0 0 91 86 1 0 0 0 92 88 1 0 0 0 88 91 1 0 0 0 88 90 1 0 0 0 88 95 1 0 0 0 93 89 1 0 0 0 94 89 1 0 0 0 M END