0 mol 0 unq 0 iso 0 dist 6.99269 9.36697 7.20999 11.9606 6.91778 7.08361 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 7.86009 4.02431 8.20058 11.7049 8.60554 13.4836 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 7.86009 4.02431 8.20058 10.0448 8.44664 11.9824 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 7.86009 4.02431 8.20058 5.16721 9.44691 9.04355 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 7.66368 6.74704 5.90776 4.45164 5.37007 5.47738 numMergedOcc 0
5 mol 100 unq 0 iso 0 dist 5.1385 6.2293 5.70279 6.32568 8.30845 10.838 numMergedOcc 0
6 mol 100 unq 1 iso 0 dist 5.1385 6.2293 5.70279 13.341 8.76378 11.4018 numMergedOcc 0
7 mol 100 unq 2 iso 0 dist 4.86758 12.107 8.92577 8.26794 7.38135 5.48646 numMergedOcc 0
8 mol 100 unq 3 iso 0 dist 4.86758 8.6363 9.56324 8.26794 7.38135 11.0196 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 9.82508 14.6799 8.99949 13.1547 8.70296 10.5805 numMergedOcc 0
10 mol 131 unq 1 iso 0 dist 9.82508 14.6799 8.99949 9.05974 9.25558 8.98062 numMergedOcc 0
11 mol 158 unq 0 iso 0 dist 9.88821 9.33066 8.59098 5.45755 8.647 4.29509 numMergedOcc 0
12 mol 213 unq 0 iso 0 dist 5.33408 10.7212 9.75141 7.66404 8.14332 10.9044 numMergedOcc 0
13 mol 232 unq 0 iso 0 dist 8.58719 6.88422 8.89211 10.0667 8.50102 7.46856 numMergedOcc 0
14 mol 232 unq 1 iso 0 dist 9.64301 10.3553 8.89211 14.6567 8.50102 7.46856 numMergedOcc 0
15 mol 240 unq 0 iso 0 dist 7.46026 11.7518 9.68888 7.47497 6.68687 5.24149 numMergedOcc 0
16 mol 274 unq 0 iso 0 dist 6.34391 6.85449 5.82876 5.40393 7.46394 4.48276 numMergedOcc 0
17 mol 274 unq 1 iso 0 dist 7.85517 6.85449 8.71129 5.40393 7.1729 4.48276 numMergedOcc 0
