0 mol 20 unq 0 iso 0 dist 9.37411 9.00405 7.47395 12.2773 5.39275 8.93826 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 9.37411 9.00405 7.47395 8.67226 5.17224 7.17695 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 8.33405 9.36667 9.13228 14.6012 7.57764 9.54314 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 5.58102 4.77009 6.5816 9.32242 4.48773 9.68556 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 5.58102 4.77009 6.5816 6.17173 3.78499 8.73928 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 6.61697 5.70681 5.31126 10.1152 3.74516 7.96893 numMergedOcc 0
6 mol 120 unq 0 iso 0 dist 8.0889 8.14689 7.84207 10.792 8.9188 9.16089 numMergedOcc 0
7 mol 128 unq 0 iso 0 dist 7.12662 9.10228 7.76123 7.4738 3.81254 5.38983 numMergedOcc 0
8 mol 128 unq 1 iso 0 dist 7.12662 9.10228 7.76123 8.88867 7.67031 8.46801 numMergedOcc 0
9 mol 128 unq 2 iso 0 dist 9.38 9.10228 6.08651 7.4738 6.13996 5.38983 numMergedOcc 0
10 mol 128 unq 3 iso 0 dist 9.38 9.10228 6.08651 8.88867 4.62046 8.46801 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 5.96324 6.34139 5.60448 14.3613 10.5537 9.48934 numMergedOcc 0
12 mol 141 unq 1 iso 0 dist 5.96324 6.34139 5.60448 6.74947 5.51254 6.41183 numMergedOcc 0
13 mol 169 unq 0 iso 0 dist 6.85177 5.73931 5.10589 10.2888 3.69097 7.78577 numMergedOcc 0
14 mol 169 unq 1 iso 0 dist 8.88729 5.73931 4.63336 10.2888 7.14832 7.78577 numMergedOcc 0
15 mol 169 unq 2 iso 0 dist 7.07933 12.9917 6.96715 9.19569 5.74428 9.58901 numMergedOcc 0
16 mol 254 unq 0 iso 0 dist 8.26189 12.399 7.85841 13.9715 5.81468 7.89302 numMergedOcc 0
17 mol 254 unq 1 iso 0 dist 7.57834 12.6878 9.20109 15.2067 8.51317 7.89302 numMergedOcc 0
18 mol 254 unq 2 iso 0 dist 5.75348 12.399 9.20109 13.9715 8.51317 7.89302 numMergedOcc 0
19 mol 260 unq 0 iso 0 dist 8.90109 8.71923 7.04263 7.46 3.43711 7.88108 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 8.70774 14.9564 7.98956 18.0713 14.313 8.72101 numMergedOcc 0
21 mol 277 unq 1 iso 0 dist 8.70774 14.9564 7.98956 15.8242 7.31817 5.11998 numMergedOcc 0
22 mol 281 unq 0 iso 0 dist 9.73306 12.2582 7.90368 18.79 13.5758 6.82918 numMergedOcc 0
23 mol 281 unq 1 iso 0 dist 7.8046 7.60311 7.90368 14.3162 13.5758 6.82918 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 8.27196 4.69872 6.24487 8.35178 9.94473 9.40443 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 8.27196 4.69872 6.24487 8.35178 9.94473 9.40443 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 8.27196 4.69872 6.24487 8.35178 9.94473 9.40443 numMergedOcc 0
27 mol 292 unq 0 iso 0 dist 8.06614 7.34358 8.07775 15.5732 12.2 8.85506 numMergedOcc 0
