0 mol 26 unq 0 iso 0 dist 5.71245 9.41865 9.86867 8.43523 4.03003 11.7245 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 9.073 9.25184 13.4073 8.44761 7.47006 16.2151 numMergedOcc 0
2 mol 68 unq 1 iso 0 dist 9.073 9.25184 13.4073 6.81124 4.02051 13.8355 numMergedOcc 0
3 mol 68 unq 2 iso 0 dist 9.073 9.43167 11.8672 8.44761 7.47006 15.8706 numMergedOcc 0
4 mol 68 unq 3 iso 0 dist 9.073 9.43167 11.8672 6.81124 4.02051 12.1622 numMergedOcc 0
5 mol 70 unq 0 iso 0 dist 9.2794 7.68652 15.844 6.13606 4.12515 13.2009 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 9.75708 5.74157 6.94793 8.64736 12.7681 13.2031 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 7.32868 8.58504 14.4048 6.15011 11.8069 5.60494 numMergedOcc 0
8 mol 156 unq 0 iso 0 dist 6.72426 5.56994 4.29026 6.01599 4.33572 6.89624 numMergedOcc 0
9 mol 156 unq 1 iso 0 dist 6.72426 5.56994 4.29026 5.42285 6.11369 5.66705 numMergedOcc 0
10 mol 156 unq 2 iso 0 dist 6.72426 8.99176 9.40081 6.01599 4.33572 12.4917 numMergedOcc 0
11 mol 156 unq 3 iso 0 dist 6.72426 8.99176 9.40081 5.42285 6.11369 5.80433 numMergedOcc 0
12 mol 192 unq 0 iso 0 dist 6.88947 8.8894 9.99333 9.36089 7.02086 4.71967 numMergedOcc 0
13 mol 192 unq 1 iso 0 dist 6.88947 8.8894 9.99333 8.25221 14.0195 10.8213 numMergedOcc 0
14 mol 192 unq 2 iso 0 dist 6.88947 8.8894 9.99333 6.64416 11.153 6.75301 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 8.95136 6.23909 13.3124 6.32542 4.8012 9.83112 numMergedOcc 0
16 mol 209 unq 0 iso 0 dist 6.3344 7.95916 10.1835 9.17634 7.34675 5.6104 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 9.71864 7.54031 10.704 9.36738 12.5958 5.35764 numMergedOcc 0
18 mol 220 unq 1 iso 0 dist 9.71864 9.95731 10.028 9.36738 12.5958 9.71243 numMergedOcc 0
19 mol 234 unq 0 iso 0 dist 5.65943 7.94402 9.42563 5.74541 6.06471 4.63225 numMergedOcc 0
