0 mol 5 unq 0 iso 0 dist 7.92988 10.1185 9.64713 7.24092 5.2392 5.30596 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 6.91627 12.7938 8.99098 6.62201 9.79847 15.3098 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 8.2056 10.2716 8.24798 5.34733 6.39307 4.95319 numMergedOcc 0
3 mol 18 unq 1 iso 0 dist 8.2056 10.3407 8.02079 5.34733 6.39307 6.19959 numMergedOcc 0
4 mol 30 unq 0 iso 0 dist 6.30807 5.8083 7.45133 5.03442 8.98564 9.66828 numMergedOcc 0
5 mol 30 unq 1 iso 0 dist 6.30807 5.8083 7.45133 8.04261 7.51725 9.99681 numMergedOcc 0
6 mol 62 unq 0 iso 0 dist 5.78968 6.52334 8.58588 6.44497 7.30651 5.45648 numMergedOcc 0
7 mol 81 unq 0 iso 0 dist 8.68497 6.61128 7.41802 9.65919 5.73799 4.85657 numMergedOcc 0
8 mol 81 unq 1 iso 0 dist 8.68497 6.61128 7.41802 11.4056 8.38883 8.72274 numMergedOcc 0
9 mol 83 unq 0 iso 0 dist 9.04648 15.069 7.88704 5.1778 7.84642 11.8383 numMergedOcc 0
10 mol 83 unq 1 iso 0 dist 9.04648 5.04995 9.54782 5.1778 7.84642 9.28473 numMergedOcc 0
11 mol 113 unq 0 iso 0 dist 8.28452 10.03 9.15172 7.05148 6.12348 13.6511 numMergedOcc 0
12 mol 113 unq 1 iso 0 dist 8.44004 3.97916 9.15172 13.2701 6.12348 13.6511 numMergedOcc 0
13 mol 115 unq 0 iso 0 dist 6.30982 6.64473 8.37388 3.97496 9.79864 7.88845 numMergedOcc 0
14 mol 128 unq 0 iso 0 dist 8.98367 12.3372 9.74232 6.79263 9.45412 15.6917 numMergedOcc 0
15 mol 128 unq 1 iso 0 dist 8.54297 6.81712 7.84837 12.3248 8.83385 6.57536 numMergedOcc 0
16 mol 128 unq 2 iso 0 dist 8.54297 6.81712 7.84837 10.6485 7.11781 6.90306 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 6.83539 12.0772 7.86364 6.27023 9.31012 9.74608 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 6.84088 5.32735 9.87224 3.45727 7.63381 8.15025 numMergedOcc 0
19 mol 244 unq 0 iso 0 dist 7.00974 12.6177 8.19381 5.9726 9.11416 14.199 numMergedOcc 0
20 mol 244 unq 1 iso 0 dist 7.00974 11.5282 8.93421 5.9726 9.11416 15.195 numMergedOcc 0
21 mol 244 unq 2 iso 0 dist 7.00974 12.6014 7.35657 5.9726 9.11416 16.1506 numMergedOcc 0
22 mol 244 unq 3 iso 0 dist 7.00974 5.30507 6.19605 5.9726 9.11416 9.34983 numMergedOcc 0
23 mol 256 unq 0 iso 0 dist 9.36652 15.6445 8.88264 4.80469 7.23526 13.7649 numMergedOcc 0
24 mol 256 unq 1 iso 0 dist 7.54613 11.974 8.88264 4.07811 7.23526 13.7649 numMergedOcc 0
25 mol 279 unq 0 iso 0 dist 7.98579 7.45625 7.67032 7.20921 8.41945 5.03747 numMergedOcc 0
26 mol 283 unq 0 iso 0 dist 8.28068 5.72409 5.96202 8.21071 7.81241 5.83652 numMergedOcc 0
27 mol 283 unq 1 iso 0 dist 8.28068 5.72409 5.96202 6.36596 9.52445 5.99759 numMergedOcc 0
