0 mol 12 unq 0 iso 0 dist 5.9021 6.6051 4.86727 7.81704 4.49007 6.6691 11.1357 11.4552 8.18139 9.59648 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 5.9021 6.6051 4.86727 11.1322 8.59739 9.23807 11.1357 11.4552 8.18139 8.43141 numMergedOcc 0
2 mol 12 unq 2 iso 0 dist 5.9021 6.6051 4.86727 13.5603 14.0611 9.52857 11.1357 11.4552 8.18139 5.21734 numMergedOcc 0
3 mol 12 unq 3 iso 0 dist 8.98466 6.6051 10.763 7.81704 15.7238 6.6691 11.1357 16.0264 8.18139 9.59648 numMergedOcc 0
4 mol 12 unq 4 iso 0 dist 8.98466 6.6051 10.763 11.1322 18.986 9.23807 11.1357 16.0264 8.18139 8.43141 numMergedOcc 0
5 mol 12 unq 5 iso 0 dist 8.98466 6.6051 10.763 13.5603 15.4089 9.52857 11.1357 16.0264 8.18139 5.21734 numMergedOcc 0
6 mol 48 unq 0 iso 0 dist 7.38928 5.35252 5.03338 11.0398 14.4137 9.48288 5.76698 12.5606 8.8645 8.23404 numMergedOcc 0
7 mol 48 unq 1 iso 0 dist 8.36915 9.53081 13.2937 10.7098 13.0397 8.82709 12.665 16.7433 7.34325 5.20775 numMergedOcc 0
8 mol 48 unq 2 iso 0 dist 8.36915 9.53081 13.2937 10.7098 13.0397 8.82709 14.1985 18.0898 6.42037 8.11954 numMergedOcc 0
9 mol 48 unq 3 iso 0 dist 6.01454 9.53081 5.41488 10.7098 6.99001 8.82709 12.665 8.94842 7.34325 5.20775 numMergedOcc 0
10 mol 48 unq 4 iso 0 dist 6.01454 9.53081 5.41488 10.7098 6.99001 8.82709 14.1985 9.9555 6.42037 8.11954 numMergedOcc 0
11 mol 73 unq 0 iso 0 dist 8.4438 4.34694 9.65371 10.9054 15.997 7.20403 4.93697 7.75341 7.47162 12.669 numMergedOcc 0
12 mol 79 unq 0 iso 0 dist 7.41952 8.64686 9.57704 8.69896 13.0659 5.33546 7.18389 12.7824 7.82966 4.07065 numMergedOcc 0
13 mol 79 unq 1 iso 0 dist 7.41952 8.64686 9.57704 8.69896 13.0659 5.33546 11.5374 16.3634 8.26763 3.99035 numMergedOcc 0
14 mol 79 unq 2 iso 0 dist 7.41952 8.64686 9.57704 8.69896 13.0659 5.33546 5.21981 10.7273 6.30814 4.53016 numMergedOcc 0
15 mol 79 unq 3 iso 0 dist 7.41952 8.64686 9.57704 8.69896 13.0659 5.33546 8.12985 8.0318 7.318 9.19585 numMergedOcc 0
16 mol 91 unq 0 iso 0 dist 5.78962 8.91354 7.47242 12.671 12.6261 7.12701 5.09341 7.77953 9.84288 10.6223 numMergedOcc 0
17 mol 105 unq 0 iso 0 dist 8.80388 6.11833 5.89806 8.65154 14.0385 8.40598 11.7553 11.6586 9.15226 13.4342 numMergedOcc 0
18 mol 105 unq 1 iso 0 dist 8.8689 7.12201 5.89806 11.2367 14.0385 8.40598 8.79469 11.6586 9.15226 13.4342 numMergedOcc 0
19 mol 105 unq 2 iso 0 dist 7.28156 6.11833 6.96209 8.65154 13.2285 8.40598 11.7553 14.5892 9.15226 13.4342 numMergedOcc 0
20 mol 105 unq 3 iso 0 dist 9.18139 7.12201 6.96209 11.2367 13.2285 8.40598 8.79469 14.5892 9.15226 13.4342 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 7.02662 6.72718 6.12748 14.2953 9.91805 8.91143 13.4486 13.507 8.09915 12.8343 numMergedOcc 0
22 mol 210 unq 0 iso 0 dist 6.41444 8.05949 7.48216 7.26107 8.87054 9.24401 10.8542 10.0723 7.80421 5.65439 numMergedOcc 0
23 mol 210 unq 1 iso 0 dist 6.41444 8.05949 7.48216 7.26107 8.87054 9.24401 14.6074 16.6086 9.71107 13.0319 numMergedOcc 0
24 mol 210 unq 2 iso 0 dist 6.41444 8.05949 7.48216 7.26107 8.87054 9.24401 13.6787 16.5751 9.7449 13.8317 numMergedOcc 0
25 mol 236 unq 0 iso 0 dist 7.6402 7.74348 13.5224 8.52618 13.7846 5.91739 7.69003 12.4099 8.75172 3.86189 numMergedOcc 0
26 mol 266 unq 0 iso 0 dist 9.77392 9.0836 16.492 8.25534 10.3937 9.34312 7.90149 14.1584 8.9221 6.17867 numMergedOcc 0
27 mol 277 unq 0 iso 0 dist 6.23539 6.66936 5.95045 5.41599 5.92532 9.35976 5.38166 8.18813 6.42951 6.64795 numMergedOcc 0
