0 mol 128 unq 0 iso 0 dist 5.4104 4.73835 7.33617 6.12126 6.31583 9.11128 numMergedOcc 0
1 mol 160 unq 0 iso 0 dist 8.67846 7.26169 8.83016 9.9938 6.33257 9.50008 numMergedOcc 0
2 mol 186 unq 0 iso 0 dist 5.97162 6.78172 7.17789 11.6649 12.8874 5.80433 numMergedOcc 0
3 mol 186 unq 1 iso 0 dist 5.97162 6.78172 7.17789 11.4673 12.3457 6.8285 numMergedOcc 0
4 mol 228 unq 0 iso 0 dist 7.4244 10.0549 9.21065 17.0184 12.8284 7.97746 numMergedOcc 0
5 mol 228 unq 1 iso 0 dist 7.40089 5.67892 9.23333 13.4362 10.356 9.84486 numMergedOcc 0
6 mol 228 unq 2 iso 0 dist 7.40089 5.67892 9.23333 10.7164 13.0333 7.81837 numMergedOcc 0
7 mol 228 unq 3 iso 0 dist 8.21976 5.67892 7.24491 13.4362 6.67895 9.84486 numMergedOcc 0
8 mol 228 unq 4 iso 0 dist 8.21976 5.67892 7.24491 10.7164 8.00573 7.81837 numMergedOcc 0
9 mol 228 unq 5 iso 0 dist 7.19441 9.76534 9.23333 13.7644 10.356 9.84486 numMergedOcc 0
10 mol 228 unq 6 iso 0 dist 7.19441 9.76534 9.23333 16.7222 13.0333 7.81837 numMergedOcc 0
11 mol 228 unq 7 iso 0 dist 7.21082 5.95601 9.21065 11.1117 12.8284 7.97746 numMergedOcc 0
12 mol 228 unq 8 iso 0 dist 8.81908 5.95601 7.65917 11.1117 7.6598 7.97746 numMergedOcc 0
13 mol 233 unq 0 iso 0 dist 6.09111 6.13888 8.41604 8.98366 6.99665 5.64376 numMergedOcc 0
14 mol 236 unq 0 iso 0 dist 6.35418 7.55924 6.25412 7.05868 4.99523 9.88216 numMergedOcc 0
15 mol 260 unq 0 iso 0 dist 7.5129 6.39739 5.16772 10.3067 4.91827 7.58405 numMergedOcc 0
16 mol 260 unq 1 iso 0 dist 7.5129 6.39739 5.16772 9.50619 8.29529 7.26115 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 7.19754 5.87542 5.96033 8.70062 8.6202 8.40198 numMergedOcc 0
18 mol 287 unq 1 iso 0 dist 7.19754 5.87542 5.96033 9.919 5.64526 9.95761 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 7.19754 5.87542 5.96033 8.70062 8.6202 8.40198 numMergedOcc 0
20 mol 288 unq 1 iso 0 dist 7.19754 5.87542 5.96033 9.919 5.64526 9.95761 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 7.19754 5.87542 5.96033 8.70062 8.6202 8.40198 numMergedOcc 0
22 mol 289 unq 1 iso 0 dist 7.19754 5.87542 5.96033 9.919 5.64526 9.95761 numMergedOcc 0
