0 mol 33 unq 0 iso 0 dist 5.65377 7.15141 6.08005 6.96521 8.41282 9.63263 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 7.31362 7.16036 5.68567 9.32021 12.4904 7.52117 numMergedOcc 0
2 mol 100 unq 0 iso 0 dist 7.3098 5.09688 5.06206 5.25231 11.3447 9.00544 numMergedOcc 0
3 mol 100 unq 1 iso 0 dist 7.3098 5.09688 5.06206 6.16378 9.70095 7.12017 numMergedOcc 0
4 mol 100 unq 2 iso 0 dist 9.90038 9.26343 5.06206 8.90536 11.3447 9.00544 numMergedOcc 0
5 mol 100 unq 3 iso 0 dist 9.90038 9.26343 5.06206 5.69359 9.70095 7.12017 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 7.65424 4.93035 4.93029 5.74529 11.1973 6.69515 numMergedOcc 0
7 mol 141 unq 1 iso 0 dist 7.65424 9.75558 10.28 5.74529 11.1973 7.86572 numMergedOcc 0
8 mol 141 unq 2 iso 0 dist 6.71654 4.93035 4.37081 5.74529 8.92412 6.69515 numMergedOcc 0
9 mol 141 unq 3 iso 0 dist 6.71654 9.75558 6.23566 5.74529 8.92412 7.86572 numMergedOcc 0
10 mol 167 unq 0 iso 0 dist 7.62006 4.93984 7.01116 6.31396 13.2447 9.94125 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 8.46429 5.63906 7.37734 8.39509 9.18314 9.83476 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 8.46429 5.63906 7.37734 6.91649 13.1202 6.258 numMergedOcc 0
13 mol 192 unq 0 iso 0 dist 9.44978 9.05666 4.94984 6.93447 10.9886 7.24199 numMergedOcc 0
14 mol 196 unq 0 iso 0 dist 9.66622 6.64506 9.06228 11.9967 12.5032 8.20691 numMergedOcc 0
15 mol 196 unq 1 iso 0 dist 9.66622 6.64506 9.06228 5.39297 13.0151 5.85777 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 7.24101 7.2527 10.2134 9.87539 8.24118 6.66971 numMergedOcc 0
17 mol 238 unq 1 iso 0 dist 7.24101 7.13194 5.88384 9.87539 8.24118 7.32982 numMergedOcc 0
18 mol 252 unq 0 iso 0 dist 6.4889 9.78185 9.42665 13.7796 15.7499 7.50201 numMergedOcc 0
19 mol 258 unq 0 iso 0 dist 9.8256 7.22378 6.62225 4.56307 8.82933 6.70815 numMergedOcc 0
