0 mol 4 unq 0 iso 0 dist 6.34563 9.80438 7.02535 14.6895 14.9045 8.93278 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 6.34563 9.80438 7.02535 3.25279 7.77633 8.68164 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 9.55415 7.17695 4.8515 9.45728 7.61139 7.99756 numMergedOcc 0
3 mol 20 unq 1 iso 0 dist 9.55415 7.17695 4.8515 4.76485 6.54552 4.36087 numMergedOcc 0
4 mol 20 unq 2 iso 0 dist 9.55415 9.33207 3.51645 4.76485 6.54552 7.09639 numMergedOcc 0
5 mol 34 unq 0 iso 0 dist 9.18109 7.36836 15.1968 6.99091 10.0836 7.34832 numMergedOcc 0
6 mol 62 unq 0 iso 0 dist 9.3913 7.25138 12.5032 5.56988 10.9112 7.16844 numMergedOcc 0
7 mol 67 unq 0 iso 0 dist 6.23298 8.4702 11.6017 3.77705 9.06101 5.88409 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 6.88786 5.57551 5.37935 6.56256 6.37273 8.19932 numMergedOcc 0
9 mol 79 unq 0 iso 0 dist 8.71103 7.06029 8.14479 10.0025 16.3634 9.04293 numMergedOcc 0
10 mol 79 unq 1 iso 0 dist 8.71103 7.06029 8.14479 6.35003 10.7273 4.78333 numMergedOcc 0
11 mol 93 unq 0 iso 0 dist 7.62629 5.10693 7.08249 3.91263 11.283 6.67678 numMergedOcc 0
12 mol 93 unq 1 iso 0 dist 7.62629 6.58814 8.37319 3.91263 11.283 7.24956 numMergedOcc 0
13 mol 93 unq 2 iso 0 dist 7.62629 6.13459 9.47729 3.91263 11.283 8.28591 numMergedOcc 0
14 mol 93 unq 3 iso 0 dist 7.62629 6.13459 9.47729 5.59024 12.3817 5.35008 numMergedOcc 0
15 mol 93 unq 4 iso 0 dist 7.62629 6.13459 9.47729 12.9872 16.0185 8.30921 numMergedOcc 0
16 mol 93 unq 5 iso 0 dist 7.62629 7.54391 8.88832 3.91263 11.283 9.40687 numMergedOcc 0
17 mol 93 unq 6 iso 0 dist 7.62629 7.54391 8.88832 5.59024 12.3817 8.84576 numMergedOcc 0
18 mol 93 unq 7 iso 0 dist 7.62629 7.54391 8.88832 12.9872 16.0185 7.39732 numMergedOcc 0
19 mol 101 unq 0 iso 0 dist 5.5199 6.67863 4.19577 13.2642 12.6901 9.33112 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 9.71223 6.99587 5.56574 3.6848 9.82338 9.17458 numMergedOcc 0
21 mol 186 unq 1 iso 0 dist 9.71223 6.99587 5.56574 5.33968 7.99933 6.94594 numMergedOcc 0
22 mol 186 unq 2 iso 0 dist 9.71223 4.37577 7.76011 3.6848 9.82338 7.36794 numMergedOcc 0
23 mol 186 unq 3 iso 0 dist 9.71223 4.37577 7.76011 5.33968 7.99933 5.81881 numMergedOcc 0
24 mol 186 unq 4 iso 0 dist 9.12583 7.69952 4.41312 6.21273 10.7466 8.17928 numMergedOcc 0
25 mol 243 unq 0 iso 0 dist 9.19579 6.46793 12.5873 6.76489 8.07313 9.53137 numMergedOcc 0
26 mol 255 unq 0 iso 0 dist 8.22083 7.80616 6.60718 5.98092 11.1351 8.7958 numMergedOcc 0
27 mol 278 unq 0 iso 0 dist 6.97456 9.93392 12.1009 3.86293 10.2629 9.67239 numMergedOcc 0
