0 mol 29 unq 0 iso 0 dist 5.36278 8.9204 7.29489 5.3571 9.78134 9.41017 7.71924 8.02814 4.40181 7.71617 numMergedOcc 0
1 mol 29 unq 1 iso 0 dist 7.50258 9.19374 5.07025 12.1835 9.78134 14.8344 14.2409 8.02814 12.0063 7.71617 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 9.53081 6.42242 5.84184 12.665 7.34325 10.6858 6.01454 5.41488 6.98858 8.94842 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 9.53081 6.42242 5.84184 14.1985 6.42037 10.7881 6.01454 5.41488 6.98858 9.9555 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 5.66803 9.23947 8.95689 7.91421 7.11238 15.4915 6.08228 5.88036 11.3115 8.13162 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 4.34694 6.82707 10.5011 4.93697 7.47162 8.4701 8.4438 9.65371 7.94629 7.75341 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 8.64686 7.99438 14.0351 8.12985 7.318 14.9591 7.41952 9.57704 9.30887 8.0318 numMergedOcc 0
7 mol 79 unq 1 iso 0 dist 8.64686 6.64915 13.4228 8.12985 7.318 14.7047 7.41952 9.57704 11.3722 8.0318 numMergedOcc 0
8 mol 91 unq 0 iso 0 dist 8.91354 6.93893 5.06999 5.09341 9.84288 8.77355 5.78962 7.47242 9.0185 7.77953 numMergedOcc 0
9 mol 195 unq 0 iso 0 dist 7.2833 9.25935 8.71774 6.01032 6.65077 13.3723 10.5568 9.10689 16.6859 5.08438 numMergedOcc 0
10 mol 220 unq 0 iso 0 dist 6.50756 8.32948 11.1785 4.606 9.5745 10.8716 8.98362 5.82963 14.9758 9.21416 numMergedOcc 0
11 mol 239 unq 0 iso 0 dist 8.48545 6.91534 9.08479 3.28983 9.993 8.95511 10.2234 16.88 13.0625 7.69491 numMergedOcc 0
12 mol 239 unq 1 iso 0 dist 8.48545 6.91534 9.08479 3.28983 9.993 8.95511 8.34832 14.2079 15.1473 6.64008 numMergedOcc 0
13 mol 239 unq 2 iso 0 dist 8.48545 8.67704 5.88166 3.28983 9.993 11.3228 10.2234 16.88 17.3981 7.69491 numMergedOcc 0
14 mol 239 unq 3 iso 0 dist 8.48545 8.67704 5.88166 3.28983 9.993 11.3228 8.34832 14.2079 16.5164 6.64008 numMergedOcc 0
15 mol 279 unq 0 iso 0 dist 8.03486 9.29922 15.4124 4.91802 8.34313 7.17958 5.78017 7.78018 13.4771 8.9352 numMergedOcc 0
16 mol 279 unq 1 iso 0 dist 8.03486 9.29922 15.4124 4.91802 8.34313 7.17958 8.78203 5.38411 12.7014 5.8845 numMergedOcc 0
