0 mol 7 unq 0 iso 0 dist 6.72215 8.02892 6.55304 6.11915 6.02702 6.14469 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 5.59773 5.7405 4.29856 14.2744 10.4031 9.17082 numMergedOcc 0
2 mol 60 unq 0 iso 0 dist 8.82095 9.34193 9.49968 13.1258 10.1323 8.97364 numMergedOcc 0
3 mol 60 unq 1 iso 0 dist 6.27749 9.34193 5.32257 13.1258 11.6165 8.97364 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 7.86724 8.66742 9.52327 5.97684 5.9465 5.50508 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 9.59261 4.96613 11.3905 5.24592 5.78706 7.14031 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 6.67936 4.96613 4.67519 5.24592 5.59328 7.14031 numMergedOcc 0
7 mol 98 unq 2 iso 0 dist 8.25817 4.96613 10.4027 5.24592 7.5242 7.14031 numMergedOcc 0
8 mol 112 unq 0 iso 0 dist 6.85381 9.69961 5.39346 9.59885 10.7886 7.80873 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 9.93703 6.13508 7.45148 5.01597 8.99399 7.20249 numMergedOcc 0
10 mol 156 unq 0 iso 0 dist 7.30021 9.6281 5.4555 9.69888 9.4013 8.37434 numMergedOcc 0
11 mol 156 unq 1 iso 0 dist 6.71202 6.22667 6.03934 5.36066 11.1147 8.37434 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 6.00053 5.67112 7.16549 5.87168 6.59025 5.94379 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 7.66381 9.53805 8.14815 8.03698 9.19 6.21159 numMergedOcc 0
14 mol 232 unq 0 iso 0 dist 8.68464 6.23146 11.776 13.2043 15.4363 9.8664 numMergedOcc 0
15 mol 237 unq 0 iso 0 dist 9.39201 5.62039 6.72874 8.50643 11.902 8.10254 numMergedOcc 0
16 mol 265 unq 0 iso 0 dist 9.59213 7.49913 13.9888 11.806 20.9069 8.984 numMergedOcc 0
17 mol 274 unq 0 iso 0 dist 7.80446 8.30714 13.0115 8.44509 15.8636 7.75216 numMergedOcc 0
18 mol 274 unq 1 iso 0 dist 9.86142 8.30714 11.5044 8.44509 16.7828 7.75216 numMergedOcc 0
19 mol 274 unq 2 iso 0 dist 8.66451 9.02661 6.70925 14.7933 12.2077 6.88827 numMergedOcc 0
20 mol 274 unq 3 iso 0 dist 8.66451 9.02661 6.70925 7.09841 10.5387 9.16942 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 8.57532 5.92532 6.82888 5.10104 10.6985 8.20644 numMergedOcc 0
22 mol 277 unq 1 iso 0 dist 9.02914 5.92532 4.37645 5.10104 12.1618 8.20644 numMergedOcc 0
23 mol 277 unq 2 iso 0 dist 6.90434 5.92532 7.70529 5.10104 10.8214 8.20644 numMergedOcc 0
