0 mol 51 unq 0 iso 0 dist 9.66898 8.55004 4.9987 7.12423 12.4834 13.4355 13.6102 18.8646 18.5377 9.0709 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 4.67917 5.41134 6.07398 6.65344 5.34079 6.34748 5.29688 8.05508 9.05547 6.85766 numMergedOcc 0
2 mol 59 unq 1 iso 0 dist 4.67917 5.41134 6.07398 6.65344 5.34079 6.34748 13.1729 12.5028 13.5562 7.71095 numMergedOcc 0
3 mol 59 unq 2 iso 0 dist 4.67917 9.23605 11.9466 6.65344 5.34079 13.0793 5.29688 8.05508 12.9592 6.85766 numMergedOcc 0
4 mol 59 unq 3 iso 0 dist 4.67917 9.23605 11.9466 6.65344 5.34079 13.0793 13.1729 12.5028 19.6226 7.71095 numMergedOcc 0
5 mol 59 unq 4 iso 0 dist 6.88924 5.41134 4.58297 6.65344 6.11334 6.34748 5.29688 10.7085 9.05547 6.85766 numMergedOcc 0
6 mol 59 unq 5 iso 0 dist 6.88924 5.41134 4.58297 6.65344 6.11334 6.34748 13.1729 13.6406 13.5562 7.71095 numMergedOcc 0
7 mol 59 unq 6 iso 0 dist 6.88924 9.23605 10.8174 6.65344 6.11334 13.0793 5.29688 10.7085 12.9592 6.85766 numMergedOcc 0
8 mol 59 unq 7 iso 0 dist 6.88924 9.23605 10.8174 6.65344 6.11334 13.0793 13.1729 13.6406 19.6226 7.71095 numMergedOcc 0
9 mol 71 unq 0 iso 0 dist 9.44364 7.28815 4.29097 9.50139 4.32794 5.87956 6.53623 10.0915 8.21553 7.38797 numMergedOcc 0
10 mol 95 unq 0 iso 0 dist 8.36326 9.02302 7.01145 9.65047 16.7208 13.209 5.33325 12.146 10.2352 7.27724 numMergedOcc 0
11 mol 95 unq 1 iso 0 dist 8.36326 9.02302 7.01145 9.65047 16.7208 13.209 5.69671 12.7234 12.7489 8.03644 numMergedOcc 0
12 mol 129 unq 0 iso 0 dist 9.0455 7.13958 5.0466 9.28278 5.56946 4.80675 14.5776 13.5311 10.1938 8.54584 numMergedOcc 0
13 mol 132 unq 0 iso 0 dist 8.883 9.00166 16.0548 8.7366 12.3669 6.04014 4.90475 11.8382 6.2403 7.7059 numMergedOcc 0
14 mol 132 unq 1 iso 0 dist 8.883 7.16287 7.68244 8.7366 12.3669 10.0823 4.90475 11.8382 6.495 7.7059 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 7.12336 4.69402 6.49614 5.86531 5.37072 6.25005 6.26797 9.50322 10.4155 7.11802 numMergedOcc 0
16 mol 133 unq 1 iso 0 dist 7.12336 4.69402 6.49614 5.86531 5.37072 6.25005 9.73435 5.82404 11.4588 8.00618 numMergedOcc 0
17 mol 210 unq 0 iso 0 dist 9.718 5.33103 7.38779 8.62103 14.2438 11.5481 3.84723 11.8313 6.53736 6.18308 numMergedOcc 0
18 mol 210 unq 1 iso 0 dist 9.718 9.01301 7.88141 8.62103 14.2438 8.72811 3.84723 11.8313 8.18851 6.18308 numMergedOcc 0
19 mol 210 unq 2 iso 0 dist 8.61629 5.33103 8.44804 8.62103 11.4281 11.5481 3.84723 10.4825 6.53736 6.18308 numMergedOcc 0
20 mol 210 unq 3 iso 0 dist 8.61629 9.01301 6.935 8.62103 11.4281 8.72811 3.84723 10.4825 8.18851 6.18308 numMergedOcc 0
21 mol 214 unq 0 iso 0 dist 8.80167 7.1951 5.31666 4.84709 5.67031 3.99247 4.55245 10.961 10.8385 8.82096 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 8.37512 9.52903 11.3847 5.73834 4.16729 9.78068 6.48867 9.98141 14.0712 6.60405 numMergedOcc 0
23 mol 258 unq 1 iso 0 dist 8.37512 9.52903 11.3847 5.73834 4.16729 9.78068 7.52881 10.3938 8.81059 6.42289 numMergedOcc 0
24 mol 259 unq 0 iso 0 dist 7.34794 8.06908 6.92619 9.54857 5.41945 6.18571 15.3806 10.5892 13.6279 7.46176 numMergedOcc 0
