0 mol 8 unq 0 iso 0 dist 7.46102 3.69663 4.92734 9.47227 6.31827 6.26138 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 7.46102 3.69663 4.92734 9.91301 8.4069 6.57999 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 9.47227 3.69663 6.26138 7.46102 6.31827 4.92734 numMergedOcc 0
3 mol 8 unq 3 iso 0 dist 9.47227 3.69663 6.26138 9.91301 5.27819 6.57999 numMergedOcc 0
4 mol 8 unq 4 iso 0 dist 9.91301 11.375 6.4754 15.6504 6.23795 7.3795 numMergedOcc 0
5 mol 8 unq 5 iso 0 dist 9.91301 3.69663 6.57999 7.46102 8.4069 4.92734 numMergedOcc 0
6 mol 8 unq 6 iso 0 dist 9.91301 3.69663 6.57999 9.47227 5.27819 6.26138 numMergedOcc 0
7 mol 25 unq 0 iso 0 dist 8.88413 5.30126 6.22122 10.5993 4.33106 9.22151 numMergedOcc 0
8 mol 30 unq 0 iso 0 dist 8.609 4.64354 6.83481 9.44073 5.34368 9.28932 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 8.2377 6.46551 6.10011 12.864 5.7113 8.124 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 6.18305 12.2435 8.124 9.43662 5.7113 6.10011 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 8.58841 13.4991 5.56964 17.86 10.2879 8.41567 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 8.3164 7.12319 8.84523 11.4135 4.98336 9.45397 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 9.60411 13.5049 7.27598 14.0674 5.00817 5.57904 numMergedOcc 0
14 mol 154 unq 0 iso 0 dist 9.93555 7.19596 8.34737 13.4861 5.62851 8.5163 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 9.58911 7.56512 6.58792 9.86845 6.01247 8.90247 numMergedOcc 0
16 mol 224 unq 0 iso 0 dist 8.39002 4.61429 9.73411 9.2053 5.60236 7.75485 numMergedOcc 0
17 mol 224 unq 1 iso 0 dist 8.39002 11.1139 7.07564 9.2053 5.60236 9.11052 numMergedOcc 0
18 mol 224 unq 2 iso 0 dist 9.2053 4.61429 7.75485 8.39002 5.60236 9.73411 numMergedOcc 0
19 mol 224 unq 3 iso 0 dist 9.2053 11.1139 9.11052 8.39002 5.60236 7.07564 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 9.66555 5.12308 4.87108 11.6545 5.34096 7.64276 numMergedOcc 0
21 mol 238 unq 1 iso 0 dist 8.67205 4.29839 4.87108 11.1363 5.34096 7.64276 numMergedOcc 0
22 mol 253 unq 0 iso 0 dist 8.91612 9.02763 8.68368 12.868 8.02948 9.02643 numMergedOcc 0
23 mol 274 unq 0 iso 0 dist 9.52894 9.82234 8.71129 10.0379 6.15918 5.82876 numMergedOcc 0
