0 mol 7 unq 0 iso 0 dist 7.31201 9.36807 6.57017 5.44992 9.55056 7.45262 7.10621 10.789 10.515 5.72491 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.31201 9.36807 6.57017 5.44992 9.55056 7.45262 12.2333 12.2708 6.06176 7.88043 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.31201 9.36807 6.57017 4.74523 7.57354 6.96586 12.2333 12.2708 6.06176 8.80762 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 9.36807 7.31201 6.57017 5.44992 7.45262 9.55056 7.10621 10.515 10.789 5.72491 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 9.36807 7.31201 6.57017 5.44992 7.45262 9.55056 12.2333 6.06176 12.2708 7.88043 numMergedOcc 0
5 mol 7 unq 5 iso 0 dist 9.36807 7.31201 6.57017 4.74523 6.96586 7.57354 12.2333 6.06176 12.2708 8.80762 numMergedOcc 0
6 mol 9 unq 0 iso 0 dist 6.33889 6.85412 5.80437 11.0722 9.82483 10.4906 15.1483 13.5628 11.4276 7.05346 numMergedOcc 0
7 mol 16 unq 0 iso 0 dist 8.41862 6.58035 10.9633 6.70071 7.40724 11.6017 5.46498 6.73355 5.94084 6.56335 numMergedOcc 0
8 mol 16 unq 1 iso 0 dist 8.41862 6.58035 10.9633 6.70071 7.40724 11.6017 9.80614 4.77289 10.9337 7.2668 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 6.99777 9.14376 11.889 7.3094 9.9928 9.68845 7.88312 11.7126 4.62962 5.72642 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 6.19042 9.38288 6.59581 7.61939 9.87025 15.0419 9.87172 6.35763 11.7228 7.99857 numMergedOcc 0
11 mol 119 unq 1 iso 0 dist 6.19042 9.38288 6.59581 7.61939 9.87025 15.0419 12.6489 10.0197 16.1459 8.56342 numMergedOcc 0
12 mol 119 unq 2 iso 0 dist 6.19042 7.44174 8.58342 7.61939 9.87025 5.85818 9.87172 6.35763 7.36192 7.99857 numMergedOcc 0
13 mol 119 unq 3 iso 0 dist 6.19042 7.44174 8.58342 7.61939 9.87025 5.85818 12.6489 10.0197 10.6679 8.56342 numMergedOcc 0
14 mol 119 unq 4 iso 0 dist 7.44174 9.38288 11.6138 7.61939 5.85818 15.0419 9.87172 7.36192 11.7228 7.99857 numMergedOcc 0
15 mol 119 unq 5 iso 0 dist 7.44174 9.38288 11.6138 7.61939 5.85818 15.0419 12.6489 10.6679 16.1459 8.56342 numMergedOcc 0
16 mol 119 unq 6 iso 0 dist 7.44174 6.19042 8.58342 7.61939 5.85818 9.87025 9.87172 7.36192 6.35763 7.99857 numMergedOcc 0
17 mol 119 unq 7 iso 0 dist 7.44174 6.19042 8.58342 7.61939 5.85818 9.87025 12.6489 10.6679 10.0197 8.56342 numMergedOcc 0
18 mol 119 unq 8 iso 0 dist 8.43904 9.80862 4.84196 10.326 9.87025 14.4611 10.1813 6.35763 9.64166 7.99857 numMergedOcc 0
19 mol 119 unq 9 iso 0 dist 8.43904 9.80862 4.84196 10.326 9.87025 14.4611 9.72413 10.0197 12.6801 8.56342 numMergedOcc 0
20 mol 130 unq 0 iso 0 dist 7.66168 9.12581 6.09983 11.576 6.42785 10.3718 13.572 8.84655 6.76754 8.33077 numMergedOcc 0
21 mol 130 unq 1 iso 0 dist 7.66168 9.12581 6.09983 4.28797 6.82089 5.38314 10.3889 10.3933 9.16988 9.28592 numMergedOcc 0
22 mol 130 unq 2 iso 0 dist 6.89257 8.74308 6.09983 5.97111 6.42785 10.3718 8.70949 8.84655 6.76754 8.33077 numMergedOcc 0
23 mol 130 unq 3 iso 0 dist 6.89257 8.74308 6.09983 6.97875 6.82089 5.38314 15.2264 10.3933 9.16988 9.28592 numMergedOcc 0
24 mol 130 unq 4 iso 0 dist 9.12581 7.66168 6.09983 4.28797 5.38314 6.82089 10.3889 9.16988 10.3933 9.28592 numMergedOcc 0
25 mol 130 unq 5 iso 0 dist 8.74308 6.89257 6.09983 6.97875 5.38314 6.82089 15.2264 9.16988 10.3933 9.28592 numMergedOcc 0
26 mol 181 unq 0 iso 0 dist 7.20046 7.13543 6.33699 5.93488 7.345 9.52987 5.98885 5.4601 10.0524 6.51749 numMergedOcc 0
27 mol 181 unq 1 iso 0 dist 7.20046 7.13543 6.33699 5.93488 7.345 9.52987 9.09537 6.14208 5.95965 7.20392 numMergedOcc 0
28 mol 181 unq 2 iso 0 dist 7.13543 7.20046 6.33699 5.93488 9.52987 7.345 5.98885 10.0524 5.4601 6.51749 numMergedOcc 0
29 mol 181 unq 3 iso 0 dist 7.13543 7.20046 6.33699 5.93488 9.52987 7.345 9.09537 5.95965 6.14208 7.20392 numMergedOcc 0
30 mol 198 unq 0 iso 0 dist 7.90031 7.21533 5.17341 6.74772 8.15936 8.16598 12.0399 5.72073 9.94078 9.18635 numMergedOcc 0
31 mol 198 unq 1 iso 0 dist 7.90031 7.21533 5.17341 6.74772 8.15936 8.16598 13.7844 12.2117 10.8191 8.10985 numMergedOcc 0
32 mol 198 unq 2 iso 0 dist 7.21533 7.90031 5.17341 6.74772 8.16598 8.15936 12.0399 9.94078 5.72073 9.18635 numMergedOcc 0
33 mol 198 unq 3 iso 0 dist 7.21533 7.90031 5.17341 6.74772 8.16598 8.15936 13.7844 10.8191 12.2117 8.10985 numMergedOcc 0
34 mol 218 unq 0 iso 0 dist 7.18041 7.17547 9.17818 5.7776 6.86795 6.61099 10.3145 6.05563 8.36122 6.29367 numMergedOcc 0
35 mol 218 unq 1 iso 0 dist 7.18041 7.17547 9.17818 5.7776 6.86795 6.61099 10.9501 9.68444 7.47048 5.76954 numMergedOcc 0
36 mol 218 unq 2 iso 0 dist 7.18041 7.17547 9.17818 5.7776 6.86795 6.61099 14.7187 11.4148 12.7963 9.20961 numMergedOcc 0
37 mol 218 unq 3 iso 0 dist 7.18041 7.17547 9.17818 5.282 6.23898 11.1742 11.7007 7.35842 16.1837 8.0751 numMergedOcc 0
38 mol 218 unq 4 iso 0 dist 7.17547 7.18041 9.17818 10.3246 9.67381 13.5976 10.9501 7.47048 9.68444 8.06216 numMergedOcc 0
39 mol 218 unq 5 iso 0 dist 7.17547 7.18041 9.17818 5.7776 6.61099 6.86795 10.3145 8.36122 6.05563 6.29367 numMergedOcc 0
40 mol 218 unq 6 iso 0 dist 7.17547 7.18041 9.17818 5.7776 6.61099 6.86795 10.9501 7.47048 9.68444 5.76954 numMergedOcc 0
41 mol 218 unq 7 iso 0 dist 7.17547 7.18041 9.17818 5.7776 6.61099 6.86795 14.7187 12.7963 11.4148 9.20961 numMergedOcc 0
42 mol 218 unq 8 iso 0 dist 7.13323 9.50586 4.63933 9.8301 9.67381 14.2989 12.8943 7.47048 11.0503 8.06216 numMergedOcc 0
43 mol 218 unq 9 iso 0 dist 7.13323 9.50586 4.63933 9.97783 6.61099 10.4247 14.6103 8.36122 10.4605 6.29367 numMergedOcc 0
44 mol 218 unq 10 iso 0 dist 7.13323 9.50586 4.63933 9.97783 6.61099 10.4247 12.8943 7.47048 11.0503 5.76954 numMergedOcc 0
45 mol 218 unq 11 iso 0 dist 7.13323 9.50586 4.63933 9.97783 6.61099 10.4247 18.1262 12.7963 15.8716 9.20961 numMergedOcc 0
46 mol 227 unq 0 iso 0 dist 6.95902 9.62609 8.55671 7.22396 7.1372 10.841 8.65997 6.43754 14.6185 8.03442 numMergedOcc 0
47 mol 238 unq 0 iso 0 dist 6.55759 7.02475 6.44245 7.83352 8.6597 7.47235 7.31233 10.4664 11.2717 5.64181 numMergedOcc 0
48 mol 238 unq 1 iso 0 dist 6.55759 7.02475 6.44245 7.83352 8.6597 7.47235 13.1583 13.3539 14.7509 7.61393 numMergedOcc 0
49 mol 238 unq 2 iso 0 dist 6.55759 7.67322 10.677 7.83352 8.6597 10.3116 7.31233 10.4664 12.6986 5.64181 numMergedOcc 0
50 mol 238 unq 3 iso 0 dist 6.55759 7.67322 10.677 7.83352 8.6597 10.3116 13.1583 13.3539 17.6983 7.61393 numMergedOcc 0
51 mol 238 unq 4 iso 0 dist 6.55759 7.19008 12.1411 7.83352 8.6597 6.44735 7.31233 10.4664 5.17471 5.64181 numMergedOcc 0
52 mol 238 unq 5 iso 0 dist 6.55759 7.19008 12.1411 7.83352 8.6597 6.44735 13.1583 13.3539 10.7999 7.61393 numMergedOcc 0
53 mol 238 unq 6 iso 0 dist 7.02475 6.55759 6.44245 7.83352 7.47235 8.6597 7.31233 11.2717 10.4664 5.64181 numMergedOcc 0
54 mol 238 unq 7 iso 0 dist 7.02475 6.55759 6.44245 7.83352 7.47235 8.6597 13.1583 14.7509 13.3539 7.61393 numMergedOcc 0
55 mol 238 unq 8 iso 0 dist 7.02475 7.67322 5.44694 7.83352 7.47235 10.3116 7.31233 11.2717 12.6986 5.64181 numMergedOcc 0
56 mol 238 unq 9 iso 0 dist 7.02475 7.67322 5.44694 7.83352 7.47235 10.3116 13.1583 14.7509 17.6983 7.61393 numMergedOcc 0
57 mol 238 unq 10 iso 0 dist 7.02475 7.19008 10.1756 7.83352 7.47235 6.44735 7.31233 11.2717 5.17471 5.64181 numMergedOcc 0
58 mol 238 unq 11 iso 0 dist 7.02475 7.19008 10.1756 7.83352 7.47235 6.44735 13.1583 14.7509 10.7999 7.61393 numMergedOcc 0
59 mol 238 unq 12 iso 0 dist 7.67322 6.55759 10.677 11.0349 7.61203 15.7712 11.5794 11.6239 17.2608 5.52379 numMergedOcc 0
60 mol 238 unq 13 iso 0 dist 7.67322 7.02475 5.44694 11.0349 7.61203 11.0295 11.5794 11.6239 14.2685 5.52379 numMergedOcc 0
61 mol 238 unq 14 iso 0 dist 7.67322 7.19008 9.50847 11.0349 7.61203 6.89694 11.5794 11.6239 5.54325 5.52379 numMergedOcc 0
62 mol 238 unq 15 iso 0 dist 9.68513 5.9216 4.83721 5.87253 9.47845 6.92409 10.0419 13.9614 12.3042 5.52379 numMergedOcc 0
63 mol 238 unq 16 iso 0 dist 5.9216 9.68513 4.83721 5.87253 6.92409 9.47845 10.0419 12.3042 13.9614 5.52379 numMergedOcc 0
64 mol 238 unq 17 iso 0 dist 7.19008 6.55759 12.1411 11.0349 6.89694 15.7712 11.5794 5.54325 17.2608 5.52379 numMergedOcc 0
65 mol 238 unq 18 iso 0 dist 7.19008 6.55759 12.1411 7.83352 6.44735 8.6597 7.31233 5.17471 10.4664 5.64181 numMergedOcc 0
66 mol 238 unq 19 iso 0 dist 7.19008 6.55759 12.1411 7.83352 6.44735 8.6597 13.1583 10.7999 13.3539 7.61393 numMergedOcc 0
67 mol 238 unq 20 iso 0 dist 7.19008 7.02475 10.1756 11.0349 6.89694 11.0295 11.5794 5.54325 14.2685 5.52379 numMergedOcc 0
68 mol 238 unq 21 iso 0 dist 7.19008 7.02475 10.1756 7.83352 6.44735 7.47235 7.31233 5.17471 11.2717 5.64181 numMergedOcc 0
69 mol 238 unq 22 iso 0 dist 7.19008 7.02475 10.1756 7.83352 6.44735 7.47235 13.1583 10.7999 14.7509 7.61393 numMergedOcc 0
70 mol 238 unq 23 iso 0 dist 7.19008 7.67322 9.50847 11.0349 6.89694 7.61203 11.5794 5.54325 11.6239 5.52379 numMergedOcc 0
71 mol 238 unq 24 iso 0 dist 7.19008 7.67322 9.50847 7.83352 6.44735 10.3116 7.31233 5.17471 12.6986 5.64181 numMergedOcc 0
72 mol 238 unq 25 iso 0 dist 7.19008 7.67322 9.50847 7.83352 6.44735 10.3116 13.1583 10.7999 17.6983 7.61393 numMergedOcc 0
73 mol 239 unq 0 iso 0 dist 7.39747 8.1777 4.89061 5.66732 7.18771 7.94894 13.6473 10.0774 9.8202 8.67805 numMergedOcc 0
74 mol 239 unq 1 iso 0 dist 8.1777 7.39747 4.89061 5.66732 7.94894 7.18771 13.6473 9.8202 10.0774 8.67805 numMergedOcc 0
75 mol 272 unq 0 iso 0 dist 6.16449 9.09992 9.75529 4.86504 7.55161 11.7075 9.97651 4.72202 10.841 9.64269 numMergedOcc 0
76 mol 272 unq 1 iso 0 dist 6.16449 9.09992 9.75529 4.86504 7.55161 11.7075 10.1698 8.5751 12.5206 6.88809 numMergedOcc 0
77 mol 272 unq 2 iso 0 dist 6.16449 9.09992 9.75529 4.86504 7.55161 11.7075 8.46116 8.52877 5.63139 8.46061 numMergedOcc 0
