0 mol 0 unq 0 iso 0 dist 9.42137 5.66453 6.26831 8.60656 7.40865 5.73813 7.31837 5.24778 6.64713 10.4616 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 7.46102 12.3138 7.3915 10.4489 8.53529 5.65816 20.0755 14.1378 8.77457 11.3039 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.46229 7.36079 7.05346 9.93406 7.32257 8.88528 13.6879 8.50424 8.076 7.35972 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 9.96265 8.17152 7.52117 12.8967 9.6782 5.1728 12.7039 4.55437 7.03307 7.48846 numMergedOcc 0
4 mol 44 unq 1 iso 0 dist 9.96265 8.17152 7.52117 12.8967 9.6782 5.1728 10.8505 6.16231 7.25707 10.3462 numMergedOcc 0
5 mol 44 unq 2 iso 0 dist 9.70459 10.0357 7.52117 13.4256 9.6782 5.1728 13.31 4.55437 7.03307 7.48846 numMergedOcc 0
6 mol 44 unq 3 iso 0 dist 9.70459 10.0357 7.52117 13.4256 9.6782 5.1728 13.2328 6.16231 7.25707 10.3462 numMergedOcc 0
7 mol 44 unq 4 iso 0 dist 7.78905 7.37043 7.52117 9.64095 9.6782 5.1728 10.53 4.55437 7.03307 7.48846 numMergedOcc 0
8 mol 44 unq 5 iso 0 dist 7.78905 7.37043 7.52117 9.64095 9.6782 5.1728 11.7913 6.16231 7.25707 10.3462 numMergedOcc 0
9 mol 44 unq 6 iso 0 dist 9.44909 6.36853 7.52117 4.83412 9.6782 5.1728 9.45566 4.55437 7.03307 7.48846 numMergedOcc 0
10 mol 44 unq 7 iso 0 dist 9.44909 6.36853 7.52117 4.83412 9.6782 5.1728 12.3808 6.16231 7.25707 10.3462 numMergedOcc 0
11 mol 56 unq 0 iso 0 dist 7.20538 9.91757 6.77886 3.63144 7.16773 8.25666 15.6645 10.0962 6.99108 14.7378 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 7.5819 7.07175 8.65802 4.00923 7.52354 5.8102 10.5329 13.534 8.57827 12.3938 numMergedOcc 0
13 mol 92 unq 1 iso 0 dist 7.5819 7.07175 8.65802 4.00923 7.52354 5.8102 10.8943 5.83515 7.94453 10.5663 numMergedOcc 0
14 mol 98 unq 0 iso 0 dist 5.9747 8.89866 7.26086 7.43001 6.65501 11.2092 10.9995 7.06961 8.43352 6.88901 numMergedOcc 0
15 mol 98 unq 1 iso 0 dist 4.50572 7.87523 7.26086 9.5305 6.65501 11.2092 11.1541 7.06961 8.43352 6.88901 numMergedOcc 0
16 mol 119 unq 0 iso 0 dist 6.40546 6.64646 7.99623 5.73999 8.99399 4.99495 8.4733 7.45148 9.9151 7.20249 numMergedOcc 0
17 mol 131 unq 0 iso 0 dist 7.81337 6.99491 9.29384 4.34786 8.70296 10.8127 12.2564 13.1439 5.44303 15.6807 numMergedOcc 0
18 mol 131 unq 1 iso 0 dist 7.81337 6.99491 9.29384 4.34786 8.70296 10.8127 15.1282 13.7237 8.50562 18.6956 numMergedOcc 0
19 mol 131 unq 2 iso 0 dist 7.81337 6.99491 9.29384 11.6607 9.25558 11.2516 12.2564 13.1439 5.44303 14.8175 numMergedOcc 0
20 mol 131 unq 3 iso 0 dist 7.81337 6.99491 9.29384 11.6607 9.25558 11.2516 15.1282 13.7237 8.50562 13.2952 numMergedOcc 0
21 mol 162 unq 0 iso 0 dist 8.25167 5.49559 8.00506 4.13881 6.45896 4.56165 11.8662 9.0783 8.21989 11.3082 numMergedOcc 0
