0 mol 0 unq 0 iso 0 dist 7.31837 4.59249 7.30381 5.66453 6.64713 6.58151 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 5.66743 3.9551 7.18409 5.82138 7.45532 5.80624 numMergedOcc 0
2 mol 27 unq 1 iso 0 dist 5.66743 5.10645 6.21163 5.82138 7.45532 10.2629 numMergedOcc 0
3 mol 27 unq 2 iso 0 dist 7.42669 10.978 7.18409 9.93763 7.45532 5.80624 numMergedOcc 0
4 mol 27 unq 3 iso 0 dist 7.42669 5.00553 6.21163 9.93763 7.45532 10.2629 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 5.84625 7.7624 7.88172 9.05877 6.62229 9.94237 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 7.07989 7.13073 6.34966 5.79348 8.91427 6.48823 numMergedOcc 0
7 mol 68 unq 1 iso 0 dist 9.77272 13.7884 6.34966 11.1344 8.91427 6.48823 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 9.16592 14.9354 9.95103 15.7109 9.5669 6.04919 numMergedOcc 0
9 mol 112 unq 0 iso 0 dist 5.42828 8.86411 9.69961 6.84906 9.77017 4.26804 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 8.27794 5.80915 7.78223 11.393 9.35942 10.8586 numMergedOcc 0
11 mol 114 unq 1 iso 0 dist 8.27794 5.80915 7.78223 13.5888 7.42482 11.0397 numMergedOcc 0
12 mol 116 unq 0 iso 0 dist 7.6005 5.17486 6.63731 13.0273 8.79367 8.27695 numMergedOcc 0
13 mol 116 unq 1 iso 0 dist 8.7583 6.28627 6.63731 13.1111 8.79367 8.27695 numMergedOcc 0
14 mol 119 unq 0 iso 0 dist 8.4733 9.73554 6.13508 6.64646 9.9151 7.09096 numMergedOcc 0
15 mol 120 unq 0 iso 0 dist 8.73484 13.5076 9.37051 4.63594 6.03352 9.0525 numMergedOcc 0
16 mol 163 unq 0 iso 0 dist 7.81715 5.05407 9.57242 15.0568 9.79069 13.5919 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 7.58256 12.9239 9.53805 5.47232 5.45675 8.99916 numMergedOcc 0
18 mol 206 unq 0 iso 0 dist 8.15381 4.58247 6.69623 5.87422 9.14486 7.03009 numMergedOcc 0
19 mol 206 unq 1 iso 0 dist 8.15381 9.70849 6.21951 5.87422 9.14486 7.29508 numMergedOcc 0
20 mol 220 unq 0 iso 0 dist 7.4513 5.13031 9.05637 5.37508 5.37796 8.06536 numMergedOcc 0
21 mol 226 unq 0 iso 0 dist 7.04477 5.02367 9.61639 7.77366 6.26945 11.7881 numMergedOcc 0
22 mol 232 unq 0 iso 0 dist 7.83422 8.47021 6.23146 7.65577 8.28466 8.14788 numMergedOcc 0
23 mol 237 unq 0 iso 0 dist 8.42502 6.26246 5.62039 6.68355 5.06628 5.91026 numMergedOcc 0
24 mol 253 unq 0 iso 0 dist 9.69704 17.557 9.6479 9.82329 8.15091 12.0513 numMergedOcc 0
25 mol 256 unq 0 iso 0 dist 5.66817 4.29865 7.40057 8.84384 8.89892 13.0191 numMergedOcc 0
26 mol 285 unq 0 iso 0 dist 8.60489 6.52069 8.35007 3.60708 8.16947 6.6406 numMergedOcc 0
27 mol 285 unq 1 iso 0 dist 8.76332 13.6976 9.56169 3.60708 6.74142 10.36 numMergedOcc 0
28 mol 285 unq 2 iso 0 dist 8.76332 6.52069 8.02964 3.60708 6.74142 6.6406 numMergedOcc 0
