0 mol 14 unq 0 iso 0 dist 8.54362 5.80918 8.23238 4.76499 6.28466 8.79533 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 9.942 9.89704 5.2568 11.7226 5.83277 8.16059 numMergedOcc 0
2 mol 55 unq 0 iso 0 dist 8.77395 9.62261 9.07741 10.94 7.15195 8.96223 numMergedOcc 0
3 mol 55 unq 1 iso 0 dist 6.91288 9.62261 8.0388 10.94 4.09906 8.96223 numMergedOcc 0
4 mol 55 unq 2 iso 0 dist 8.60087 9.62261 9.7883 10.94 11.4933 8.96223 numMergedOcc 0
5 mol 83 unq 0 iso 0 dist 7.25594 4.21416 7.88522 6.98288 6.97401 7.78306 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 5.35509 13.8322 9.80185 19.0247 16.1482 8.51265 numMergedOcc 0
7 mol 148 unq 0 iso 0 dist 8.99827 6.5387 7.53552 6.18528 10.527 9.74966 numMergedOcc 0
8 mol 150 unq 0 iso 0 dist 8.97634 6.67151 7.49948 6.13554 10.5134 9.87914 numMergedOcc 0
9 mol 156 unq 0 iso 0 dist 6.10125 4.50134 9.15935 10.7592 15.4738 6.67598 numMergedOcc 0
10 mol 156 unq 1 iso 0 dist 6.10125 4.50134 9.15935 4.65525 7.92829 8.34508 numMergedOcc 0
11 mol 156 unq 2 iso 0 dist 6.10125 7.18347 8.24388 10.7592 15.4738 8.98636 numMergedOcc 0
12 mol 176 unq 0 iso 0 dist 7.02812 13.682 8.56192 12.1772 5.5435 7.02608 numMergedOcc 0
13 mol 184 unq 0 iso 0 dist 8.20517 16.3549 8.98606 18.0276 10.5517 5.13722 numMergedOcc 0
14 mol 184 unq 1 iso 0 dist 9.15923 3.95306 8.98606 6.66619 10.5517 5.13722 numMergedOcc 0
15 mol 184 unq 2 iso 0 dist 6.03505 9.14602 8.98606 10.3667 10.5517 5.13722 numMergedOcc 0
16 mol 213 unq 0 iso 0 dist 7.86605 10.3239 6.81437 14.3724 9.28886 8.84278 numMergedOcc 0
17 mol 249 unq 0 iso 0 dist 6.32658 6.06312 9.38713 10.5445 11.9148 5.66519 numMergedOcc 0
18 mol 253 unq 0 iso 0 dist 8.86676 14.3975 9.137 14.9686 6.10294 9.35766 numMergedOcc 0
19 mol 265 unq 0 iso 0 dist 7.71301 12.4974 6.80043 18.6538 11.5884 8.19772 numMergedOcc 0
20 mol 285 unq 0 iso 0 dist 6.41777 9.64395 8.26827 8.6446 3.46565 8.78148 numMergedOcc 0
21 mol 285 unq 1 iso 0 dist 6.41777 6.59466 7.9002 8.6446 3.46565 8.33415 numMergedOcc 0
