0 mol 7 unq 0 iso 0 dist 9.26914 8.96896 6.22805 12.1468 7.10621 6.96396 numMergedOcc 0
1 mol 95 unq 0 iso 0 dist 6.12086 11.5303 8.26838 13.7041 9.03572 4.33346 numMergedOcc 0
2 mol 95 unq 1 iso 0 dist 6.12086 11.5303 8.26838 11.3093 8.83255 7.47119 numMergedOcc 0
3 mol 95 unq 2 iso 0 dist 6.12086 11.5303 8.26838 4.98369 8.03644 15.4217 numMergedOcc 0
4 mol 95 unq 3 iso 0 dist 7.93544 11.0259 8.26838 11.3277 9.03572 4.33346 numMergedOcc 0
5 mol 95 unq 4 iso 0 dist 7.93544 11.0259 8.26838 5.822 8.83255 7.47119 numMergedOcc 0
6 mol 95 unq 5 iso 0 dist 7.93544 11.0259 8.26838 9.11942 8.03644 15.4217 numMergedOcc 0
7 mol 112 unq 0 iso 0 dist 5.43031 8.84625 9.43616 5.21064 7.71338 10.746 numMergedOcc 0
8 mol 132 unq 0 iso 0 dist 8.54009 7.45818 6.2403 4.98777 7.7059 6.04014 numMergedOcc 0
9 mol 132 unq 1 iso 0 dist 8.54009 9.99801 6.495 4.98777 7.7059 10.0823 numMergedOcc 0
10 mol 206 unq 0 iso 0 dist 6.78537 5.19724 8.73396 9.45246 7.7366 6.35321 numMergedOcc 0
11 mol 210 unq 0 iso 0 dist 7.08106 12.7761 8.07523 5.42209 6.18308 13.3929 numMergedOcc 0
12 mol 210 unq 1 iso 0 dist 7.08106 9.84393 7.56882 5.42209 6.18308 12.3088 numMergedOcc 0
13 mol 231 unq 0 iso 0 dist 6.52115 10.8929 9.98232 12.4148 7.37839 10.9863 numMergedOcc 0
14 mol 231 unq 1 iso 0 dist 6.52115 10.8929 9.98232 14.0894 8.40182 10.2117 numMergedOcc 0
15 mol 231 unq 2 iso 0 dist 9.88437 10.7278 9.98232 5.20569 7.37839 10.9863 numMergedOcc 0
16 mol 231 unq 3 iso 0 dist 9.88437 10.7278 9.98232 8.35245 8.40182 10.2117 numMergedOcc 0
17 mol 253 unq 0 iso 0 dist 7.84754 6.27092 8.53729 14.7198 9.02271 16.1265 numMergedOcc 0
18 mol 253 unq 1 iso 0 dist 7.84754 4.19317 8.07341 14.7198 9.02271 16.581 numMergedOcc 0
19 mol 253 unq 2 iso 0 dist 6.71362 9.73058 8.53729 9.60213 9.02271 16.1265 numMergedOcc 0
20 mol 253 unq 3 iso 0 dist 6.71362 9.39037 8.07341 9.60213 9.02271 16.581 numMergedOcc 0
21 mol 265 unq 0 iso 0 dist 7.27446 5.41518 7.54805 8.07916 8.4218 12.5953 numMergedOcc 0
22 mol 272 unq 0 iso 0 dist 9.32985 4.86721 4.78812 7.59176 8.33638 5.27123 numMergedOcc 0
23 mol 272 unq 1 iso 0 dist 5.50002 12.0426 6.62923 10.4754 9.97651 11.9042 numMergedOcc 0
24 mol 272 unq 2 iso 0 dist 5.50002 12.0426 6.62923 12.6468 8.46116 5.27123 numMergedOcc 0
