0 mol 16 unq 0 iso 0 dist 9.56648 5.48395 5.84479 6.36377 5.35079 6.31718 4.78943 9.18436 6.92781 5.05803 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 9.56648 5.48395 5.84479 12.9591 6.53177 7.63133 10.1011 8.67719 5.32694 5.46498 numMergedOcc 0
2 mol 16 unq 2 iso 0 dist 9.56648 5.48395 5.84479 12.9591 6.53177 7.63133 14.8742 13.4596 10.4155 8.71745 numMergedOcc 0
3 mol 16 unq 3 iso 0 dist 9.56648 10.1011 8.67719 12.9591 6.53177 5.46498 5.48395 5.84479 5.32694 7.63133 numMergedOcc 0
4 mol 16 unq 4 iso 0 dist 9.56648 10.1011 8.67719 12.9591 6.53177 5.46498 14.8742 13.4596 5.74188 8.71745 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 5.58346 4.69583 6.89722 11.0671 10.4716 9.96396 15.7901 11.7436 15.7123 9.38498 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 5.58346 4.69583 6.89722 11.0671 10.4716 9.96396 15.8603 14.4206 12.016 9.75218 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 9.10386 15.7901 9.68526 11.0671 8.31041 9.38498 4.69583 7.26679 15.7123 9.96396 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 9.10386 15.7901 9.68526 11.0671 8.31041 9.38498 15.8603 9.30776 13.7412 9.75218 numMergedOcc 0
9 mol 73 unq 4 iso 0 dist 9.10386 4.69583 7.26679 11.0671 8.31041 9.96396 15.7901 9.68526 15.7123 9.38498 numMergedOcc 0
10 mol 73 unq 5 iso 0 dist 9.10386 4.69583 7.26679 11.0671 8.31041 9.96396 15.8603 9.30776 12.016 9.75218 numMergedOcc 0
11 mol 73 unq 6 iso 0 dist 9.10386 15.8603 9.30776 11.0671 8.31041 9.75218 4.69583 7.26679 12.016 9.96396 numMergedOcc 0
12 mol 73 unq 7 iso 0 dist 9.10386 15.8603 9.30776 11.0671 8.31041 9.75218 15.7901 9.68526 13.7412 9.38498 numMergedOcc 0
13 mol 73 unq 8 iso 0 dist 9.66744 8.59095 6.89722 17.4799 10.4716 9.96396 20.0381 11.7436 15.7123 9.38498 numMergedOcc 0
14 mol 73 unq 9 iso 0 dist 9.66744 8.59095 6.89722 17.4799 10.4716 9.96396 16.6671 14.4206 12.016 9.75218 numMergedOcc 0
15 mol 92 unq 0 iso 0 dist 9.93688 4.71849 9.514 11.0291 11.8037 7.4729 13.6329 13.0248 8.95922 6.82344 numMergedOcc 0
16 mol 92 unq 1 iso 0 dist 9.88184 9.24395 9.514 16.1796 11.8037 7.4729 16.1863 13.0248 8.95922 6.82344 numMergedOcc 0
17 mol 109 unq 0 iso 0 dist 7.66832 9.47324 8.21889 8.73648 5.5332 7.34473 4.93112 9.74643 7 8.58044 numMergedOcc 0
18 mol 109 unq 1 iso 0 dist 7.66832 9.47324 8.21889 8.73648 5.5332 7.34473 4.48038 6.86702 8.40993 9.97763 numMergedOcc 0
19 mol 109 unq 2 iso 0 dist 7.66832 4.93112 9.74643 8.73648 5.5332 8.58044 9.47324 8.21889 7 7.34473 numMergedOcc 0
20 mol 109 unq 3 iso 0 dist 7.66832 4.93112 9.74643 8.73648 5.5332 8.58044 4.48038 6.86702 6.94915 9.97763 numMergedOcc 0
21 mol 109 unq 4 iso 0 dist 7.66832 4.48038 6.86702 8.73648 5.5332 9.97763 9.47324 8.21889 8.40993 7.34473 numMergedOcc 0
22 mol 109 unq 5 iso 0 dist 7.66832 4.48038 6.86702 8.73648 5.5332 9.97763 4.93112 9.74643 6.94915 8.58044 numMergedOcc 0
23 mol 109 unq 6 iso 0 dist 8.11083 12.7688 8.21889 12.2141 5.5332 7.34473 10.5733 9.74643 7 8.58044 numMergedOcc 0
24 mol 109 unq 7 iso 0 dist 8.11083 12.7688 8.21889 12.2141 5.5332 7.34473 4.76017 6.86702 8.40993 9.97763 numMergedOcc 0
25 mol 109 unq 8 iso 0 dist 8.11083 10.5733 9.74643 12.2141 5.5332 8.58044 12.7688 8.21889 7 7.34473 numMergedOcc 0
26 mol 109 unq 9 iso 0 dist 8.11083 10.5733 9.74643 12.2141 5.5332 8.58044 4.76017 6.86702 6.94915 9.97763 numMergedOcc 0
27 mol 109 unq 10 iso 0 dist 8.11083 4.76017 6.86702 12.2141 5.5332 9.97763 12.7688 8.21889 8.40993 7.34473 numMergedOcc 0
28 mol 109 unq 11 iso 0 dist 8.11083 4.76017 6.86702 12.2141 5.5332 9.97763 10.5733 9.74643 6.94915 8.58044 numMergedOcc 0
29 mol 117 unq 0 iso 0 dist 6.81489 10.0087 7.70533 17.1533 14.3476 7.90328 15.6915 14.7579 7.22206 7.83136 numMergedOcc 0
30 mol 117 unq 1 iso 0 dist 6.81489 10.0087 7.70533 17.1533 14.3476 7.90328 16.0755 16.223 9.3584 7.0603 numMergedOcc 0
31 mol 117 unq 2 iso 0 dist 9.33403 13.5681 9.85576 11.3462 10.4589 7.90328 4.60144 12.1493 13.1058 9.84395 numMergedOcc 0
32 mol 127 unq 0 iso 0 dist 8.88979 6.09267 8.40046 13.6355 9.75166 9.30299 10.2129 12.4824 7.30196 8.14887 numMergedOcc 0
33 mol 129 unq 0 iso 0 dist 8.63018 5.56946 6.29026 13.5311 11.5533 8.54584 6.4379 10.5241 4.61027 8.53613 numMergedOcc 0
34 mol 133 unq 0 iso 0 dist 6.85651 4.84607 8.84018 9.3894 8.00493 6.5107 13.0836 15.1254 9.56949 9.52634 numMergedOcc 0
35 mol 133 unq 1 iso 0 dist 9.21256 13.46 6.11955 9.84918 7.96098 6.80239 14.8707 10.4171 7.81217 6.29155 numMergedOcc 0
36 mol 133 unq 2 iso 0 dist 9.21256 13.46 6.11955 9.84918 7.96098 6.80239 14.4095 11.5405 7.79672 8.00618 numMergedOcc 0
37 mol 133 unq 3 iso 0 dist 8.3243 13.7612 6.11955 11.3707 7.96098 6.80239 14.5617 10.4171 7.81217 6.29155 numMergedOcc 0
38 mol 133 unq 4 iso 0 dist 8.3243 13.7612 6.11955 11.3707 7.96098 6.80239 17.145 11.5405 7.79672 8.00618 numMergedOcc 0
39 mol 133 unq 5 iso 0 dist 8.95239 12.9605 6.11955 11.8159 7.96098 6.80239 11.4104 10.4171 7.81217 6.29155 numMergedOcc 0
40 mol 133 unq 6 iso 0 dist 8.95239 12.9605 6.11955 11.8159 7.96098 6.80239 18.7538 11.5405 7.79672 8.00618 numMergedOcc 0
41 mol 133 unq 7 iso 0 dist 6.23615 4.64588 6.11955 5.82404 7.96098 6.80239 10.2385 10.4171 7.81217 6.29155 numMergedOcc 0
42 mol 133 unq 8 iso 0 dist 6.23615 4.64588 6.11955 5.82404 7.96098 6.80239 5.37072 11.5405 7.79672 8.00618 numMergedOcc 0
43 mol 133 unq 9 iso 0 dist 7.03858 11.981 8.84018 14.1938 8.00493 6.5107 19.921 15.1254 9.56949 9.52634 numMergedOcc 0
44 mol 181 unq 0 iso 0 dist 4.96259 4.11061 6.00053 11.5719 11.1879 8.03334 15.0411 16.1735 13.2049 9.1374 numMergedOcc 0
45 mol 234 unq 0 iso 0 dist 9.36753 12.0816 5.89084 12.3151 4.74041 6.56247 17.6539 10.6962 6.29886 8.34494 numMergedOcc 0
46 mol 234 unq 1 iso 0 dist 9.36753 12.0816 5.89084 12.3151 4.74041 6.56247 6.94762 8.47009 7.82322 9.36357 numMergedOcc 0
47 mol 234 unq 2 iso 0 dist 9.36753 12.0816 5.89084 7.86368 6.16697 9.45496 6.94762 8.47009 7.82322 6.7625 numMergedOcc 0
48 mol 234 unq 3 iso 0 dist 9.36753 6.94762 8.47009 12.3151 4.74041 9.36357 17.6539 10.6962 12.1694 8.34494 numMergedOcc 0
49 mol 234 unq 4 iso 0 dist 9.36753 6.94762 8.47009 12.3151 4.74041 9.36357 12.0816 5.89084 7.82322 6.56247 numMergedOcc 0
50 mol 234 unq 5 iso 0 dist 9.36753 6.94762 8.47009 7.86368 6.16697 6.7625 12.0816 5.89084 7.82322 9.45496 numMergedOcc 0
51 mol 238 unq 0 iso 0 dist 9.46728 9.23693 5.24313 14.9617 12.1448 7.31233 10.42 10.2654 5.34096 6.22714 numMergedOcc 0
52 mol 259 unq 0 iso 0 dist 5.98006 6.64729 6.77279 8.06771 5.71237 8.13497 9.79538 9.58006 4.69778 7.88519 numMergedOcc 0
53 mol 259 unq 1 iso 0 dist 5.98006 9.79538 9.58006 8.06771 5.71237 7.88519 6.64729 6.77279 4.69778 8.13497 numMergedOcc 0
54 mol 259 unq 2 iso 0 dist 5.22111 5.41945 7.93997 10.5892 14.8465 7.46176 12.1767 13.8509 6.96053 7.88519 numMergedOcc 0
55 mol 259 unq 3 iso 0 dist 5.22111 5.41945 7.93997 10.5892 14.8465 7.46176 12.8636 14.9816 7.64658 7.84554 numMergedOcc 0
56 mol 259 unq 4 iso 0 dist 5.22111 5.41945 7.93997 10.5892 14.8465 7.46176 14.4131 17.3348 10.5239 9.18903 numMergedOcc 0
57 mol 259 unq 5 iso 0 dist 8.53598 10.2837 7.93997 13.5637 14.8465 7.46176 17.0222 13.8509 6.96053 7.88519 numMergedOcc 0
58 mol 259 unq 6 iso 0 dist 8.53598 10.2837 7.93997 13.5637 14.8465 7.46176 17.1029 14.9816 7.64658 7.84554 numMergedOcc 0
59 mol 259 unq 7 iso 0 dist 8.53598 10.2837 7.93997 13.5637 14.8465 7.46176 17.2319 17.3348 10.5239 9.18903 numMergedOcc 0
