0 mol 6 unq 0 iso 0 dist 7.8489 8.96036 11.1845 7.76894 6.10198 6.24927 numMergedOcc 0
1 mol 6 unq 1 iso 0 dist 9.2859 8.96036 14.1181 7.76894 9.89331 6.24927 numMergedOcc 0
2 mol 6 unq 2 iso 0 dist 6.65664 8.96036 8.63472 7.76894 9.25229 6.24927 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 7.55854 7.49678 9.90363 6.17165 7.34462 6.47086 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 8.25884 5.04007 5.00567 9.68339 7.86899 6.32526 numMergedOcc 0
5 mol 68 unq 1 iso 0 dist 8.25884 6.60395 5.33771 9.68339 7.86899 11.4996 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 9.0101 7.52544 7.7047 9.39338 17.46 12.6371 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 9.0101 7.52544 7.7047 8.9053 15.9053 13.4778 numMergedOcc 0
8 mol 76 unq 2 iso 0 dist 9.0101 8.08674 4.00834 9.39338 17.46 17.2592 numMergedOcc 0
9 mol 76 unq 3 iso 0 dist 9.0101 8.08674 4.00834 8.9053 15.9053 15.1961 numMergedOcc 0
10 mol 76 unq 4 iso 0 dist 9.0101 8.33694 9.6911 9.39338 17.46 11.7045 numMergedOcc 0
11 mol 76 unq 5 iso 0 dist 9.0101 8.33694 9.6911 8.9053 15.9053 8.38148 numMergedOcc 0
12 mol 81 unq 0 iso 0 dist 6.03428 5.14604 5.39514 8.585 4.61706 9.22679 numMergedOcc 0
13 mol 102 unq 0 iso 0 dist 8.65586 5.90675 5.91317 6.00241 6.7038 6.43211 numMergedOcc 0
14 mol 103 unq 0 iso 0 dist 8.8763 8.84955 14.6504 8.2592 8.3456 9.13883 numMergedOcc 0
15 mol 168 unq 0 iso 0 dist 8.80094 8.66519 16.2482 6.8754 11.6784 11.0283 numMergedOcc 0
16 mol 168 unq 1 iso 0 dist 9.03681 8.66519 5.21399 6.8754 8.11196 11.0283 numMergedOcc 0
17 mol 168 unq 2 iso 0 dist 8.07126 8.35731 16.2482 9.08545 11.6784 11.0283 numMergedOcc 0
18 mol 180 unq 0 iso 0 dist 8.65601 5.314 9.74229 9.99021 7.69346 6.70303 numMergedOcc 0
19 mol 180 unq 1 iso 0 dist 5.78414 5.314 6.04558 9.99021 10.5619 6.70303 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 9.72676 5.34307 5.6932 6.98498 8.56706 5.36423 numMergedOcc 0
21 mol 236 unq 0 iso 0 dist 5.40329 7.73969 6.0905 5.50501 6.83211 10.1358 numMergedOcc 0
22 mol 239 unq 0 iso 0 dist 7.45786 8.4319 12.8324 6.35005 13.6346 10.6145 numMergedOcc 0
23 mol 239 unq 1 iso 0 dist 7.45786 8.4319 12.8324 6.97325 5.66619 8.52005 numMergedOcc 0
24 mol 239 unq 2 iso 0 dist 7.45786 8.4319 12.8324 6.36178 4.99161 12.0215 numMergedOcc 0
25 mol 258 unq 0 iso 0 dist 9.44043 9.27225 9.26732 9.41308 5.62491 7.74421 numMergedOcc 0
26 mol 294 unq 0 iso 0 dist 9.09416 5.10476 8.19972 6.20852 8.00469 9.06411 numMergedOcc 0
