0 mol 24 unq 0 iso 0 dist 5.85737 8.11143 4.19221 6.88453 8.0319 7.49157 13.0211 11.4109 8.66248 6.86014 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 7.21995 8.81562 3.83842 4.80528 8.03754 9.02471 12.8866 14.0204 12.6657 8.80331 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 7.21995 8.81562 3.83842 4.80528 8.03754 9.02471 10.6604 13.1056 14.0654 6.20293 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 7.48127 5.91098 8.58474 10.2219 14.6364 7.61521 4.83274 10.6009 3.69293 6.97941 numMergedOcc 0
4 mol 122 unq 0 iso 0 dist 8.9864 4.821 7.33765 6.28781 11.3383 4.42563 11.9171 13.1642 7.90729 8.37808 numMergedOcc 0
5 mol 129 unq 0 iso 0 dist 7.6453 4.4077 6.61102 4.80675 8.00624 7.97548 10.1938 15.4586 12.5321 8.54584 numMergedOcc 0
6 mol 129 unq 1 iso 0 dist 7.6453 4.4077 6.61102 5.57362 11.5175 9.9291 10.1938 15.4586 12.5321 8.53613 numMergedOcc 0
7 mol 129 unq 2 iso 0 dist 7.6453 8.4874 9.0678 4.80675 8.00624 9.64164 10.1938 15.4586 11.3755 8.54584 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 5.79195 9.35049 4.63862 13.1243 9.64659 5.78814 15.4604 10.2681 6.12885 6.5107 numMergedOcc 0
9 mol 143 unq 0 iso 0 dist 5.40826 5.33772 3.66518 5.11989 9.35213 8.64905 7.5984 9.02772 6.75249 5.99315 numMergedOcc 0
10 mol 205 unq 0 iso 0 dist 4.81837 8.83628 9.70513 14.3203 17.0191 9.31158 19.1456 19.6468 10.8636 9.61492 numMergedOcc 0
11 mol 205 unq 1 iso 0 dist 4.81837 8.83628 9.70513 14.3203 17.0191 9.31158 10.8734 13.5332 5.42503 7.45763 numMergedOcc 0
12 mol 205 unq 2 iso 0 dist 6.43519 8.83628 6.82382 14.3203 11.2748 9.31158 19.1456 16.5694 10.8636 9.61492 numMergedOcc 0
13 mol 205 unq 3 iso 0 dist 6.43519 8.83628 6.82382 14.3203 11.2748 9.31158 10.8734 5.58339 5.42503 7.45763 numMergedOcc 0
14 mol 214 unq 0 iso 0 dist 5.86911 9.46274 14.085 14.5108 19.5839 9.06459 9.4835 13.1789 4.15355 8.82096 numMergedOcc 0
15 mol 214 unq 1 iso 0 dist 7.89258 9.46274 12.4498 14.5108 17.6894 9.06459 9.4835 10.1543 4.15355 8.82096 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 8.15119 4.1545 9.21484 5.77904 4.81916 4.9764 8.35794 7.94155 11.8607 9.7748 numMergedOcc 0
17 mol 277 unq 1 iso 0 dist 8.15119 4.25172 10.3506 5.77904 4.81916 6.36559 8.35794 7.94155 10.9137 9.7748 numMergedOcc 0
