0 mol 1 unq 0 iso 0 dist 7.21349 7.81034 4.79345 7.90928 9.45781 9.57393 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 7.21349 9.19497 3.84685 7.90928 9.45781 12.4382 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 9.36227 5.38703 4.97265 8.16743 12.0906 8.93691 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 9.25641 7.44869 4.38569 7.23261 11.0273 11.4231 numMergedOcc 0
4 mol 44 unq 1 iso 0 dist 9.25641 7.44869 4.38569 6.20069 8.71322 6.93829 numMergedOcc 0
5 mol 78 unq 0 iso 0 dist 8.92399 8.12903 3.93886 9.4909 9.26242 9.82939 numMergedOcc 0
6 mol 155 unq 0 iso 0 dist 6.91762 9.25488 9.37545 8.02593 4.40049 8.59213 numMergedOcc 0
7 mol 155 unq 1 iso 0 dist 6.91762 8.02356 5.49557 8.02593 4.40049 6.6805 numMergedOcc 0
8 mol 155 unq 2 iso 0 dist 6.91762 9.22494 9.32017 7.62575 5.92486 10.225 numMergedOcc 0
9 mol 163 unq 0 iso 0 dist 7.5447 9.24754 14.6044 8.70104 6.00005 13.3436 numMergedOcc 0
10 mol 163 unq 1 iso 0 dist 9.04757 9.24754 9.20952 8.70104 14.0224 13.3436 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 8.86645 8.90161 10.4092 9.15368 6.22085 6.72205 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 8.86645 8.90161 10.4092 7.96182 4.48609 10.7557 numMergedOcc 0
13 mol 185 unq 0 iso 0 dist 9.56016 8.85182 4.63469 8.60027 11.0188 6.81717 numMergedOcc 0
14 mol 185 unq 1 iso 0 dist 9.56016 5.7065 13.6086 8.60027 11.0188 7.04364 numMergedOcc 0
15 mol 185 unq 2 iso 0 dist 7.92501 8.85182 9.22587 8.60027 7.3365 6.81717 numMergedOcc 0
16 mol 185 unq 3 iso 0 dist 7.92501 5.7065 9.4687 8.60027 7.3365 7.04364 numMergedOcc 0
17 mol 210 unq 0 iso 0 dist 9.718 5.70065 10.0806 6.87234 10.1799 6.86988 numMergedOcc 0
18 mol 210 unq 1 iso 0 dist 9.718 5.70065 10.0806 8.72017 5.48047 10.1915 numMergedOcc 0
19 mol 210 unq 2 iso 0 dist 8.61629 5.70065 6.89532 6.87234 8.05096 6.86988 numMergedOcc 0
20 mol 210 unq 3 iso 0 dist 8.61629 5.70065 6.89532 8.72017 6.25356 10.1915 numMergedOcc 0
21 mol 233 unq 0 iso 0 dist 7.74693 9.44671 11.8011 7.83363 5.3674 13.091 numMergedOcc 0
22 mol 233 unq 1 iso 0 dist 7.74693 7.21531 5.89828 7.83363 5.3674 10.3247 numMergedOcc 0
23 mol 243 unq 0 iso 0 dist 5.86679 8.6336 6.42012 6.9453 4.20431 4.54892 numMergedOcc 0
24 mol 243 unq 1 iso 0 dist 5.86679 9.58608 9.76752 6.9453 4.20431 12.6292 numMergedOcc 0
25 mol 243 unq 2 iso 0 dist 8.28347 8.6336 12.916 6.9453 10.5337 4.54892 numMergedOcc 0
26 mol 243 unq 3 iso 0 dist 8.28347 9.58608 4.73439 6.9453 10.5337 12.6292 numMergedOcc 0
27 mol 244 unq 0 iso 0 dist 5.06669 9.06357 5.11058 9.7208 12.8067 13.3181 numMergedOcc 0
28 mol 244 unq 1 iso 0 dist 5.65248 9.06357 10.8525 9.7208 13.5223 13.3181 numMergedOcc 0
