0 mol 58 unq 0 iso 0 dist 7.15486 7.04193 7.5247 6.58144 6.64012 10.3988 10.1107 5.24906 12.5636 6.46761 numMergedOcc 0
1 mol 58 unq 1 iso 0 dist 7.15486 7.04193 7.5247 6.58144 6.64012 10.3988 5.99959 5.11205 9.95096 7.58407 numMergedOcc 0
2 mol 58 unq 2 iso 0 dist 7.15486 7.04193 7.5247 4.98107 9.4099 11.9025 10.1107 5.24906 12.5636 9.73139 numMergedOcc 0
3 mol 58 unq 3 iso 0 dist 7.15486 7.04193 7.5247 4.98107 9.4099 11.9025 5.99959 5.11205 9.95096 6.31428 numMergedOcc 0
4 mol 58 unq 4 iso 0 dist 7.15486 8.52969 10.6169 6.58144 6.64012 13.4544 10.1107 5.24906 13.1021 6.46761 numMergedOcc 0
5 mol 58 unq 5 iso 0 dist 7.15486 8.52969 10.6169 6.58144 6.64012 13.4544 5.99959 5.11205 6.75888 7.58407 numMergedOcc 0
6 mol 58 unq 6 iso 0 dist 7.15486 8.52969 10.6169 4.98107 9.4099 9.55426 10.1107 5.24906 13.1021 9.73139 numMergedOcc 0
7 mol 58 unq 7 iso 0 dist 7.15486 8.52969 10.6169 4.98107 9.4099 9.55426 5.99959 5.11205 6.75888 6.31428 numMergedOcc 0
8 mol 58 unq 8 iso 0 dist 8.52969 7.04193 11.6716 9.0406 7.32874 15.108 5.99959 6.75888 9.95096 6.40841 numMergedOcc 0
9 mol 58 unq 9 iso 0 dist 8.52969 7.04193 11.6716 4.98107 9.55426 11.9025 10.1107 13.1021 12.5636 9.73139 numMergedOcc 0
10 mol 58 unq 10 iso 0 dist 8.52969 7.04193 11.6716 4.98107 9.55426 11.9025 5.99959 6.75888 9.95096 6.31428 numMergedOcc 0
11 mol 58 unq 11 iso 0 dist 8.52969 7.15486 10.6169 9.0406 7.32874 11.396 5.99959 6.75888 5.11205 6.40841 numMergedOcc 0
12 mol 58 unq 12 iso 0 dist 8.52969 7.15486 10.6169 4.98107 9.55426 9.4099 10.1107 13.1021 5.24906 9.73139 numMergedOcc 0
13 mol 58 unq 13 iso 0 dist 8.52969 7.15486 10.6169 4.98107 9.55426 9.4099 5.99959 6.75888 5.11205 6.31428 numMergedOcc 0
14 mol 59 unq 0 iso 0 dist 8.97292 6.85083 9.49235 14.1347 7.71095 13.9238 10.0237 5.3525 6.7583 8.24062 numMergedOcc 0
15 mol 100 unq 0 iso 0 dist 9.26343 9.91446 13.8729 16.4386 7.47343 19.3587 24.1237 15.209 25.9832 7.75343 numMergedOcc 0
16 mol 114 unq 0 iso 0 dist 6.06543 5.87387 5.59517 5.51609 7.35754 10.1937 9.91452 5.33327 9.2907 8.68821 numMergedOcc 0
17 mol 156 unq 0 iso 0 dist 7.80643 7.39961 5.76755 6.52984 7.44554 10.4649 9.89595 7.29758 9.30783 6.27641 numMergedOcc 0
18 mol 175 unq 0 iso 0 dist 8.50904 7.04318 6.2715 8.09861 9.0018 5.6234 14.6406 8.22779 10.5631 9.8589 numMergedOcc 0
19 mol 175 unq 1 iso 0 dist 8.50904 7.04318 6.2715 10.1323 7.652 9.92231 14.6406 8.22779 10.5631 7.24908 numMergedOcc 0
20 mol 175 unq 2 iso 0 dist 7.04318 8.50904 6.2715 8.09861 5.6234 9.0018 14.6406 10.5631 8.22779 9.8589 numMergedOcc 0
21 mol 175 unq 3 iso 0 dist 7.04318 8.50904 6.2715 10.1323 9.92231 7.652 14.6406 10.5631 8.22779 7.24908 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 6.96824 9.25528 11.9017 8.76337 7.63312 16.9324 10.5414 9.60512 14.8479 7.98142 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 6.96824 9.25528 11.9017 8.76337 7.63312 16.9324 13.0459 13.3389 19.7305 7.37327 numMergedOcc 0
24 mol 181 unq 2 iso 0 dist 9.25528 6.96824 11.9017 11.4901 5.98885 15.333 11.1264 5.4601 15.8166 7.20046 numMergedOcc 0
25 mol 181 unq 3 iso 0 dist 9.25528 6.96824 11.9017 11.4901 5.98885 15.333 15.1056 10.0524 20.4849 7.13543 numMergedOcc 0
26 mol 181 unq 4 iso 0 dist 9.25528 6.96824 11.9017 11.9545 9.15386 14.4936 11.1948 8.25067 8.93318 9.6668 numMergedOcc 0
27 mol 220 unq 0 iso 0 dist 8.93637 7.96424 13.4403 14.8074 9.23153 14.106 10.22 6.7067 10.8131 6.84247 numMergedOcc 0
28 mol 220 unq 1 iso 0 dist 8.93637 7.96424 13.4403 14.8074 9.23153 14.106 19.9234 15.9568 16.5317 6.99002 numMergedOcc 0
29 mol 220 unq 2 iso 0 dist 8.93637 5.40366 6.55533 14.8074 9.23153 9.55941 10.22 6.7067 5.75934 6.84247 numMergedOcc 0
30 mol 220 unq 3 iso 0 dist 8.93637 5.40366 6.55533 14.8074 9.23153 9.55941 19.9234 15.9568 14.5481 6.99002 numMergedOcc 0
31 mol 238 unq 0 iso 0 dist 9.82174 9.2521 14.0328 10.4397 6.57393 10.0756 6.54661 6.20606 10.4664 5.38637 numMergedOcc 0
32 mol 238 unq 1 iso 0 dist 9.82174 8.51359 15.8898 10.4397 6.57393 14.6071 6.54661 6.20606 13.3539 5.38637 numMergedOcc 0
33 mol 238 unq 2 iso 0 dist 9.2521 9.82174 14.0328 12.8083 6.22714 13.1053 12.0613 5.17471 17.0464 7.49471 numMergedOcc 0
34 mol 238 unq 3 iso 0 dist 9.2521 9.82174 14.0328 10.1821 7.31233 11.101 6.54661 10.4664 6.20606 6.55759 numMergedOcc 0
35 mol 238 unq 4 iso 0 dist 9.2521 9.82174 14.0328 10.1821 7.31233 11.101 8.97261 11.2717 12.5773 7.02475 numMergedOcc 0
36 mol 238 unq 5 iso 0 dist 9.2521 9.82174 14.0328 10.1821 7.31233 11.101 13.7887 12.6986 16.4866 7.67322 numMergedOcc 0
37 mol 238 unq 6 iso 0 dist 9.2521 9.82174 14.0328 10.1821 7.31233 11.101 12.0613 5.17471 17.0464 7.19008 numMergedOcc 0
38 mol 238 unq 7 iso 0 dist 9.2521 8.51359 6.85126 12.8083 6.22714 12.6642 12.0613 5.17471 10.7999 7.49471 numMergedOcc 0
39 mol 238 unq 8 iso 0 dist 9.2521 8.51359 6.85126 10.1821 7.31233 13.1583 6.54661 10.4664 13.3539 6.55759 numMergedOcc 0
40 mol 238 unq 9 iso 0 dist 9.2521 8.51359 6.85126 10.1821 7.31233 13.1583 8.97261 11.2717 14.7509 7.02475 numMergedOcc 0
41 mol 238 unq 10 iso 0 dist 9.2521 8.51359 6.85126 10.1821 7.31233 13.1583 13.7887 12.6986 17.6983 7.67322 numMergedOcc 0
42 mol 238 unq 11 iso 0 dist 9.2521 8.51359 6.85126 10.1821 7.31233 13.1583 12.0613 5.17471 10.7999 7.19008 numMergedOcc 0
43 mol 259 unq 0 iso 0 dist 6.49599 9.34738 4.86771 13.8605 7.88519 7.84554 15.0738 11.6195 11.8736 7.48005 numMergedOcc 0
44 mol 259 unq 1 iso 0 dist 6.49599 9.47382 6.96053 13.8605 7.88519 7.46176 15.0738 11.6195 5.79468 7.48005 numMergedOcc 0
45 mol 259 unq 2 iso 0 dist 9.34738 6.49599 4.86771 13.8605 7.84554 7.88519 15.0738 11.8736 11.6195 7.48005 numMergedOcc 0
46 mol 259 unq 3 iso 0 dist 9.34738 9.47382 7.64658 13.8605 7.84554 7.46176 15.0738 11.8736 5.79468 7.48005 numMergedOcc 0
47 mol 259 unq 4 iso 0 dist 9.47382 6.49599 6.96053 13.8605 7.46176 7.88519 15.0738 5.79468 11.6195 7.48005 numMergedOcc 0
48 mol 259 unq 5 iso 0 dist 9.47382 9.34738 7.64658 13.8605 7.46176 7.84554 15.0738 5.79468 11.8736 7.48005 numMergedOcc 0
49 mol 276 unq 0 iso 0 dist 7.11272 6.24808 8.84158 5.75852 6.87396 11.1437 7.3327 6.4102 10.2953 8.76347 numMergedOcc 0
50 mol 282 unq 0 iso 0 dist 7.70229 7.90792 4.66602 8.93697 8.76532 6.33524 14.2443 8.14825 7.36881 8.8673 numMergedOcc 0
51 mol 282 unq 1 iso 0 dist 7.90792 7.70229 4.66602 8.93697 6.33524 8.76532 14.2443 7.36881 8.14825 8.8673 numMergedOcc 0
