0 mol 46 unq 0 iso 0 dist 5.92771 9.942 14.4922 11.0316 7.23371 19.3217 numMergedOcc 0
1 mol 153 unq 0 iso 0 dist 5.17415 8.379 5.1218 6.4242 6.18934 11.3054 numMergedOcc 0
2 mol 158 unq 0 iso 0 dist 4.80508 4.88625 3.19759 5.784 5.78626 4.68068 numMergedOcc 0
3 mol 158 unq 1 iso 0 dist 4.80508 4.88625 3.19759 9.54264 9.8417 11.9447 numMergedOcc 0
4 mol 158 unq 2 iso 0 dist 4.88625 4.80508 3.19759 5.784 4.68068 5.78626 numMergedOcc 0
5 mol 165 unq 0 iso 0 dist 6.4503 6.72652 4.90692 6.30003 7.55302 10.1023 numMergedOcc 0
6 mol 212 unq 0 iso 0 dist 8.69747 9.27163 3.62594 6.99412 6.47726 9.10681 numMergedOcc 0
7 mol 254 unq 0 iso 0 dist 8.4346 7.97728 2.67738 11.98 8.87934 9.66687 numMergedOcc 0
8 mol 254 unq 1 iso 0 dist 8.4346 7.97728 2.67738 9.37127 9.47133 7.61537 numMergedOcc 0
9 mol 254 unq 2 iso 0 dist 7.97728 8.4346 2.67738 11.98 9.66687 8.87934 numMergedOcc 0
10 mol 254 unq 3 iso 0 dist 7.97728 8.4346 2.67738 9.37127 7.61537 9.47133 numMergedOcc 0
11 mol 265 unq 0 iso 0 dist 9.19805 7.71301 5.7556 9.17848 8.57848 10.885 numMergedOcc 0
12 mol 287 unq 0 iso 0 dist 6.23874 6.68956 4.68872 4.64631 9.2144 8.36585 numMergedOcc 0
13 mol 287 unq 1 iso 0 dist 6.68956 6.23874 4.68872 4.64631 8.36585 9.2144 numMergedOcc 0
14 mol 287 unq 2 iso 0 dist 8.20391 6.17759 4.64789 10.1218 8.09613 11.269 numMergedOcc 0
15 mol 288 unq 0 iso 0 dist 6.23874 6.68956 4.68872 4.64631 9.2144 8.36585 numMergedOcc 0
16 mol 288 unq 1 iso 0 dist 6.68956 6.23874 4.68872 4.64631 8.36585 9.2144 numMergedOcc 0
17 mol 288 unq 2 iso 0 dist 8.20391 6.17759 4.64789 10.1218 8.09613 11.269 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 6.23874 6.68956 4.68872 4.64631 9.2144 8.36585 numMergedOcc 0
19 mol 289 unq 1 iso 0 dist 6.68956 6.23874 4.68872 4.64631 8.36585 9.2144 numMergedOcc 0
20 mol 289 unq 2 iso 0 dist 8.20391 6.17759 4.64789 10.1218 8.09613 11.269 numMergedOcc 0
