0 mol 5 unq 0 iso 0 dist 8.4435 7.15734 5.7208 5.2522 6.81899 9.19117 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.4435 7.15734 5.7208 5.13643 9.22198 8.59504 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 8.4435 7.15734 5.7208 10.0436 7.89217 7.75279 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 9.02702 6.98862 5.18492 10.9364 13.8656 9.44224 numMergedOcc 0
4 mol 126 unq 0 iso 0 dist 7.83445 7.25133 8.37958 11.2933 14.9599 9.55276 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 8.79837 7.96689 11.4162 8.17831 15.2091 6.00667 numMergedOcc 0
6 mol 133 unq 1 iso 0 dist 8.79837 4.83134 12.4049 8.17831 15.2091 8.00919 numMergedOcc 0
7 mol 133 unq 2 iso 0 dist 8.33117 9.6582 11.4162 11.5137 15.2091 6.00667 numMergedOcc 0
8 mol 133 unq 3 iso 0 dist 8.33117 5.17734 12.4049 11.5137 15.2091 8.00919 numMergedOcc 0
9 mol 206 unq 0 iso 0 dist 9.6577 8.63033 11.6723 10.2573 12.4999 9.24348 numMergedOcc 0
10 mol 209 unq 0 iso 0 dist 9.05432 8.12883 6.74679 10.2809 14.5051 8.21628 numMergedOcc 0
11 mol 249 unq 0 iso 0 dist 9.39819 9.3807 12.7461 10.0609 17.162 8.73584 numMergedOcc 0
12 mol 274 unq 0 iso 0 dist 6.08059 9.07452 5.44831 9.62798 9.11322 7.32898 numMergedOcc 0
13 mol 274 unq 1 iso 0 dist 6.08059 7.21004 9.91966 5.58669 11.5204 9.32156 numMergedOcc 0
14 mol 274 unq 2 iso 0 dist 8.04439 6.12202 4.84163 6.75848 13.4466 9.70022 numMergedOcc 0
15 mol 279 unq 0 iso 0 dist 8.06324 8.57035 5.52492 7.77606 10.9187 7.08788 numMergedOcc 0
16 mol 283 unq 0 iso 0 dist 9.0626 7.88405 5.2842 6.82967 6.53354 8.63928 numMergedOcc 0
