0 mol 1 unq 0 iso 0 dist 7.21349 7.94669 4.02997 6.4181 6.25854 8.34833 numMergedOcc 0
1 mol 51 unq 0 iso 0 dist 9.66898 8.55004 4.9987 7.12423 12.4834 13.4355 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 4.67917 5.41134 6.07398 6.65344 5.34079 6.34748 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 4.67917 9.23605 11.9466 6.65344 5.34079 13.0793 numMergedOcc 0
4 mol 59 unq 2 iso 0 dist 5.81747 8.61357 6.07398 9.59244 10.6918 7.43198 numMergedOcc 0
5 mol 59 unq 3 iso 0 dist 6.88924 5.41134 4.58297 6.65344 6.11334 6.34748 numMergedOcc 0
6 mol 59 unq 4 iso 0 dist 6.88924 9.23605 10.8174 6.65344 6.11334 13.0793 numMergedOcc 0
7 mol 59 unq 5 iso 0 dist 6.81975 8.61357 4.58297 9.59244 7.5168 7.43198 numMergedOcc 0
8 mol 71 unq 0 iso 0 dist 9.44364 7.28815 4.29097 9.50139 4.32794 5.87956 numMergedOcc 0
9 mol 95 unq 0 iso 0 dist 8.36326 9.02302 7.01145 8.69069 3.96825 5.76815 numMergedOcc 0
10 mol 95 unq 1 iso 0 dist 8.36326 9.02302 7.01145 9.65047 16.7208 13.209 numMergedOcc 0
11 mol 103 unq 0 iso 0 dist 9.57953 6.36357 7.3651 4.99966 8.44658 5.54757 numMergedOcc 0
12 mol 129 unq 0 iso 0 dist 9.0455 7.13958 5.0466 9.28278 5.56946 4.80675 numMergedOcc 0
13 mol 129 unq 1 iso 0 dist 9.0455 7.13958 5.0466 8.78082 6.10584 7.01358 numMergedOcc 0
14 mol 132 unq 0 iso 0 dist 8.883 9.00166 16.0548 8.7366 12.3669 6.04014 numMergedOcc 0
15 mol 132 unq 1 iso 0 dist 8.883 7.16287 7.68244 8.7366 12.3669 10.0823 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 7.12336 4.69402 6.49614 5.86531 5.37072 6.25005 numMergedOcc 0
17 mol 139 unq 0 iso 0 dist 8.49892 5.77343 4.94393 6.34417 5.30274 4.78289 numMergedOcc 0
18 mol 154 unq 0 iso 0 dist 7.10223 7.63904 7.10961 7.26897 10.2589 6.03387 numMergedOcc 0
19 mol 176 unq 0 iso 0 dist 9.94201 6.9705 6.4738 9.66407 6.1294 5.17719 numMergedOcc 0
20 mol 185 unq 0 iso 0 dist 9.56016 8.2968 8.77077 9.878 8.20407 10.3307 numMergedOcc 0
21 mol 185 unq 1 iso 0 dist 7.92501 8.2968 10.4047 9.878 4.83776 10.3307 numMergedOcc 0
22 mol 187 unq 0 iso 0 dist 7.81168 5.82577 8.91643 9.36086 12.368 4.98423 numMergedOcc 0
23 mol 210 unq 0 iso 0 dist 9.718 5.33103 7.38779 8.62103 14.2438 11.5481 numMergedOcc 0
24 mol 210 unq 1 iso 0 dist 9.718 9.01301 7.88141 8.62103 14.2438 8.72811 numMergedOcc 0
25 mol 210 unq 2 iso 0 dist 8.61629 5.33103 8.44804 8.62103 11.4281 11.5481 numMergedOcc 0
26 mol 210 unq 3 iso 0 dist 8.61629 9.01301 6.935 8.62103 11.4281 8.72811 numMergedOcc 0
27 mol 214 unq 0 iso 0 dist 8.80167 7.1951 5.31666 4.84709 5.67031 3.99247 numMergedOcc 0
28 mol 258 unq 0 iso 0 dist 8.37512 9.52903 11.3847 5.73834 4.16729 9.78068 numMergedOcc 0
29 mol 259 unq 0 iso 0 dist 7.34794 8.06908 6.92619 9.54857 5.41945 6.18571 numMergedOcc 0
30 mol 265 unq 0 iso 0 dist 9.71346 9.81689 6.58111 7.04833 6.50018 10.4495 numMergedOcc 0
31 mol 266 unq 0 iso 0 dist 5.43053 7.51446 10.3939 8.12852 4.38226 9.80419 numMergedOcc 0
