0 mol 15 unq 0 iso 0 dist 6.61158 5.19544 6.33828 5.70754 3.70992 5.69755 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 7.7868 9.32718 6.78223 7.26165 9.43188 13.7643 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 8.84323 8.67162 7.12967 6.35779 5.27573 4.32751 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 8.84323 8.79114 9.63537 6.35779 5.27573 4.83294 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 7.00606 5.59552 4.62893 6.04223 3.93337 6.882 numMergedOcc 0
5 mol 148 unq 0 iso 0 dist 8.07915 9.80819 16.3259 6.81449 10.129 10.5863 numMergedOcc 0
6 mol 150 unq 0 iso 0 dist 7.97801 9.81665 16.2236 6.87593 9.97049 10.5688 numMergedOcc 0
7 mol 163 unq 0 iso 0 dist 8.70104 9.62943 14.1153 9.37245 12.8567 9.10855 numMergedOcc 0
8 mol 194 unq 0 iso 0 dist 7.52171 8.03512 4.68937 8.76748 12.2834 9.87573 numMergedOcc 0
9 mol 194 unq 1 iso 0 dist 6.289 8.03512 4.34256 8.76748 8.27947 9.87573 numMergedOcc 0
10 mol 210 unq 0 iso 0 dist 6.87234 9.26092 5.53185 9.49242 5.35359 3.71145 numMergedOcc 0
11 mol 210 unq 1 iso 0 dist 6.87234 9.26092 5.53185 9.25184 13.2257 11.0674 numMergedOcc 0
12 mol 210 unq 2 iso 0 dist 8.72017 9.26092 8.62085 9.49242 10.8507 3.71145 numMergedOcc 0
13 mol 210 unq 3 iso 0 dist 8.72017 9.26092 8.62085 9.25184 14.6808 11.0674 numMergedOcc 0
14 mol 222 unq 0 iso 0 dist 7.35476 5.89818 7.39748 4.90656 3.72064 3.98604 numMergedOcc 0
15 mol 222 unq 1 iso 0 dist 7.35476 9.32543 5.08928 4.90656 3.72064 7.99695 numMergedOcc 0
16 mol 232 unq 0 iso 0 dist 9.61294 9.41148 5.12599 9.67243 12.926 9.85068 numMergedOcc 0
17 mol 232 unq 1 iso 0 dist 9.61294 7.83422 16.1253 9.67243 12.926 12.3471 numMergedOcc 0
18 mol 244 unq 0 iso 0 dist 9.7208 5.79898 8.7459 5.16859 14.6378 10.1665 numMergedOcc 0
19 mol 244 unq 1 iso 0 dist 9.7208 5.79898 8.7459 4.79207 12.9566 5.68434 numMergedOcc 0
20 mol 247 unq 0 iso 0 dist 9.76925 6.18065 14.5868 4.78189 6.27561 8.67313 numMergedOcc 0
21 mol 274 unq 0 iso 0 dist 8.62431 9.11072 17.5774 9.82713 15.8795 8.87313 numMergedOcc 0
22 mol 274 unq 1 iso 0 dist 8.62431 6.83113 11.0599 9.82713 15.8795 6.97575 numMergedOcc 0
23 mol 274 unq 2 iso 0 dist 8.62431 9.44134 15.961 9.82713 15.8795 9.92055 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 9.94507 7.76945 7.39076 9.1471 5.29113 3.96271 numMergedOcc 0
25 mol 287 unq 1 iso 0 dist 9.94507 7.76945 7.39076 7.84189 11.7964 5.39801 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 9.94507 7.76945 7.39076 9.1471 5.29113 3.96271 numMergedOcc 0
27 mol 288 unq 1 iso 0 dist 9.94507 7.76945 7.39076 7.84189 11.7964 5.39801 numMergedOcc 0
28 mol 289 unq 0 iso 0 dist 9.94507 7.76945 7.39076 9.1471 5.29113 3.96271 numMergedOcc 0
29 mol 289 unq 1 iso 0 dist 9.94507 7.76945 7.39076 7.84189 11.7964 5.39801 numMergedOcc 0
