0 mol 51 unq 0 iso 0 dist 7.95419 8.65732 6.01366 17.5277 11.1772 9.77618 numMergedOcc 0
1 mol 100 unq 0 iso 0 dist 5.61016 9.68539 8.66545 13.6718 10.2399 6.03038 numMergedOcc 0
2 mol 100 unq 1 iso 0 dist 7.11187 4.18245 6.03038 11.7021 10.2399 8.66545 numMergedOcc 0
3 mol 100 unq 2 iso 0 dist 6.60356 11.3097 6.03038 16.023 10.2399 8.66545 numMergedOcc 0
4 mol 175 unq 0 iso 0 dist 8.6609 7.8384 6.24096 6.21546 6.77498 8.9395 numMergedOcc 0
5 mol 175 unq 1 iso 0 dist 6.21546 7.8384 8.9395 8.6609 6.77498 6.24096 numMergedOcc 0
6 mol 205 unq 0 iso 0 dist 9.68829 13.2974 9.83104 16.3182 8.7106 7.33624 numMergedOcc 0
7 mol 205 unq 1 iso 0 dist 7.75205 10.081 9.83104 13.3028 8.7106 7.33624 numMergedOcc 0
8 mol 206 unq 0 iso 0 dist 4.51269 4.91317 5.71819 7.65323 7.34999 8.48679 numMergedOcc 0
9 mol 206 unq 1 iso 0 dist 4.51269 4.91317 5.71819 13.9225 13.47 9.86924 numMergedOcc 0
10 mol 206 unq 2 iso 0 dist 4.51269 4.91317 5.71819 12.322 12.2766 7.44186 numMergedOcc 0
11 mol 206 unq 3 iso 0 dist 7.65323 4.91317 8.48679 4.51269 7.34999 5.71819 numMergedOcc 0
12 mol 206 unq 4 iso 0 dist 7.65323 4.91317 8.48679 13.9225 11.4087 9.86924 numMergedOcc 0
13 mol 206 unq 5 iso 0 dist 7.65323 4.91317 8.48679 12.322 13.4033 7.44186 numMergedOcc 0
14 mol 206 unq 6 iso 0 dist 8.63033 9.30262 7.44186 13.8314 12.2766 5.71819 numMergedOcc 0
15 mol 206 unq 7 iso 0 dist 8.63033 9.30262 7.44186 17.6979 13.4033 8.48679 numMergedOcc 0
16 mol 206 unq 8 iso 0 dist 8.63033 9.30262 7.44186 14.4518 6.09091 9.86924 numMergedOcc 0
17 mol 219 unq 0 iso 0 dist 4.67452 5.39853 6.65093 13.7029 16.4807 9.93514 numMergedOcc 0
18 mol 219 unq 1 iso 0 dist 9.86916 11.6173 6.65093 18.7473 16.4807 9.93514 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 7.35148 3.96711 9.57951 8.80872 7.92759 8.81279 numMergedOcc 0
20 mol 223 unq 0 iso 0 dist 9.29204 7.62322 9.5824 9.14789 4.44825 8.82318 numMergedOcc 0
21 mol 223 unq 1 iso 0 dist 9.14789 7.62322 8.82318 9.29204 4.44825 9.5824 numMergedOcc 0
22 mol 223 unq 2 iso 0 dist 8.78739 4.57163 8.82318 11.4492 4.44825 9.5824 numMergedOcc 0
23 mol 244 unq 0 iso 0 dist 6.51428 7.92205 6.26442 11.8474 5.61236 7.63134 numMergedOcc 0
24 mol 259 unq 0 iso 0 dist 8.73077 13.1019 7.94491 17.7036 11.4197 8.14526 numMergedOcc 0
25 mol 259 unq 1 iso 0 dist 8.73077 13.1019 7.94491 16.0846 12.0037 7.75803 numMergedOcc 0
26 mol 259 unq 2 iso 0 dist 6.76656 12.1307 7.94491 17.6592 11.4197 8.14526 numMergedOcc 0
27 mol 259 unq 3 iso 0 dist 6.76656 12.1307 7.94491 17.1607 12.0037 7.75803 numMergedOcc 0
28 mol 261 unq 0 iso 0 dist 6.41477 8.93055 9.17214 17.5069 15.3288 9.6169 numMergedOcc 0
29 mol 283 unq 0 iso 0 dist 7.53773 5.25699 5.7378 10.3912 11.6786 7.15632 numMergedOcc 0
