0 mol 10 unq 0 iso 0 dist 6.20404 6.47424 3.69246 5.64721 7.21183 7.30932 numMergedOcc 0
1 mol 85 unq 0 iso 0 dist 9.66549 9.27814 7.41484 11.0215 12.4333 6.2753 numMergedOcc 0
2 mol 96 unq 0 iso 0 dist 9.01153 8.6548 9.52825 9.20656 15.4548 7.68964 numMergedOcc 0
3 mol 141 unq 0 iso 0 dist 8.0302 8.34503 5.51254 6.0848 10.7102 7.43045 numMergedOcc 0
4 mol 181 unq 0 iso 0 dist 5.08796 7.24832 3.59953 8.22885 9.14877 7.39733 numMergedOcc 0
5 mol 181 unq 1 iso 0 dist 5.08796 7.24832 3.59953 5.58305 8.18021 8.74268 numMergedOcc 0
6 mol 181 unq 2 iso 0 dist 5.93515 7.24832 9.61614 8.22885 11.8202 7.39733 numMergedOcc 0
7 mol 181 unq 3 iso 0 dist 5.93515 7.24832 9.61614 5.58305 11.493 8.74268 numMergedOcc 0
8 mol 225 unq 0 iso 0 dist 9.58385 8.52735 3.49673 12.0772 12.0008 8.92555 numMergedOcc 0
9 mol 225 unq 1 iso 0 dist 6.83539 8.52735 3.42123 12.0772 7.86364 8.92555 numMergedOcc 0
10 mol 225 unq 2 iso 0 dist 6.22747 8.52735 5.59654 12.0772 10.9803 8.92555 numMergedOcc 0
11 mol 225 unq 3 iso 0 dist 9.21404 8.52735 14.7084 12.0772 20.3861 8.92555 numMergedOcc 0
12 mol 233 unq 0 iso 0 dist 9.49046 8.7499 10.934 5.21669 13.2089 9.48261 numMergedOcc 0
13 mol 243 unq 0 iso 0 dist 6.81644 7.39884 3.79865 6.58738 9.85847 7.6142 numMergedOcc 0
14 mol 274 unq 0 iso 0 dist 9.96682 5.77565 7.72539 3.93072 13.432 8.90108 numMergedOcc 0
15 mol 274 unq 1 iso 0 dist 9.96682 6.32853 8.78528 8.60551 14.7123 7.70811 numMergedOcc 0
16 mol 274 unq 2 iso 0 dist 9.96682 6.32853 8.78528 3.93072 13.432 9.98144 numMergedOcc 0
17 mol 283 unq 0 iso 0 dist 8.28068 7.17276 6.35533 5.72409 5.96202 9.33601 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 9.37044 8.4625 9.99481 5.7177 13.239 9.57637 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 9.37044 8.4625 9.99481 5.7177 13.239 9.57637 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 9.37044 8.4625 9.99481 5.7177 13.239 9.57637 numMergedOcc 0
