0 mol 26 unq 0 iso 0 dist 6.67455 10.7581 7.24149 3.30063 6.70325 12.6238 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 6.67455 6.77783 8.63881 3.30063 6.70325 7.97596 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 9.2772 11.3546 7.24149 6.79894 6.70325 12.6238 numMergedOcc 0
3 mol 26 unq 3 iso 0 dist 9.2772 5.24037 8.63881 6.79894 6.70325 7.97596 numMergedOcc 0
4 mol 33 unq 0 iso 0 dist 6.42569 8.17675 9.85464 11.3102 5.98867 10.4806 numMergedOcc 0
5 mol 33 unq 1 iso 0 dist 9.13872 5.82516 9.85464 12.71 5.98867 10.4806 numMergedOcc 0
6 mol 33 unq 2 iso 0 dist 7.27307 4.87306 9.85464 9.65713 5.98867 10.4806 numMergedOcc 0
7 mol 33 unq 3 iso 0 dist 5.73206 7.1347 9.85464 3.93232 5.98867 10.4806 numMergedOcc 0
8 mol 41 unq 0 iso 0 dist 6.91278 5.14132 9.22814 3.84207 9.14632 7.42205 numMergedOcc 0
9 mol 88 unq 0 iso 0 dist 8.87089 8.29378 7.11852 4.56066 5.60174 4.83307 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 8.79677 8.32999 6.06039 6.83136 5.87382 6.52215 numMergedOcc 0
11 mol 114 unq 1 iso 0 dist 8.79677 5.28095 9.36502 6.83136 5.87382 8.68818 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 6.9268 14.1492 8.03691 8.4707 8.98028 11.6675 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 8.19166 10.749 8.03691 6.42838 8.98028 11.6675 numMergedOcc 0
14 mol 157 unq 0 iso 0 dist 8.78412 9.06676 8.18826 6.11737 9.46735 12.7342 numMergedOcc 0
15 mol 183 unq 0 iso 0 dist 6.0782 9.54124 8.55287 9.03854 8.69656 4.56996 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 6.36789 9.58526 7.46024 12.2056 8.92335 4.30589 numMergedOcc 0
17 mol 193 unq 0 iso 0 dist 6.66555 7.57363 6.00381 11.9413 9.00084 4.69617 numMergedOcc 0
18 mol 193 unq 1 iso 0 dist 6.66555 5.8139 9.3817 11.9413 9.00084 10.3393 numMergedOcc 0
19 mol 230 unq 0 iso 0 dist 5.19913 5.26751 7.08409 6.2863 9.62914 11.3508 numMergedOcc 0
20 mol 230 unq 1 iso 0 dist 5.19913 5.26751 7.08409 12.1033 9.73038 15.1066 numMergedOcc 0
