0 mol 14 unq 0 iso 0 dist 8.25832 6.45858 5.45641 7.23894 8.97998 10.0712 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 9.25641 9.96265 16.532 4.1456 8.49525 14.0332 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 4.67917 6.65344 5.34079 9.75263 8.11934 12.7146 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 5.81747 9.59244 10.6918 6.8954 8.11934 16.2554 numMergedOcc 0
4 mol 81 unq 0 iso 0 dist 5.96486 9.08307 5.65355 8.74391 8.18695 12.9912 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 7.72434 7.91337 12.3603 6.33908 9.41415 14.1442 numMergedOcc 0
6 mol 119 unq 1 iso 0 dist 7.72434 6.40546 6.0968 6.33908 9.41415 11.0532 numMergedOcc 0
7 mol 132 unq 0 iso 0 dist 8.883 8.7366 12.3669 11.846 8.31873 18.1162 numMergedOcc 0
8 mol 132 unq 1 iso 0 dist 8.883 8.25314 13.3474 7.23769 5.25894 13.6184 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 7.12336 5.86531 5.37072 9.72036 6.31523 10.6275 numMergedOcc 0
10 mol 171 unq 0 iso 0 dist 8.59783 6.07091 9.22906 14.1071 9.2747 17.5872 numMergedOcc 0
11 mol 171 unq 1 iso 0 dist 8.59783 6.07091 9.22906 12.3288 8.45343 15.4307 numMergedOcc 0
12 mol 183 unq 0 iso 0 dist 8.7143 5.83071 7.68618 7.7128 8.76105 11.9673 numMergedOcc 0
13 mol 183 unq 1 iso 0 dist 8.7143 7.07224 9.81623 7.7128 8.76105 12.4572 numMergedOcc 0
14 mol 183 unq 2 iso 0 dist 8.7143 9.82101 4.73001 7.7128 8.76105 12.0716 numMergedOcc 0
15 mol 219 unq 0 iso 0 dist 7.13496 4.87446 4.95329 4.24863 8.72341 6.12768 numMergedOcc 0
16 mol 219 unq 1 iso 0 dist 7.13496 7.49235 4.26247 4.24863 8.72341 7.19159 numMergedOcc 0
17 mol 232 unq 0 iso 0 dist 5.29561 9.56029 4.43222 3.49606 6.15462 10.4461 numMergedOcc 0
18 mol 234 unq 0 iso 0 dist 7.50665 7.50424 5.44171 3.52422 8.71535 9.18589 numMergedOcc 0
19 mol 251 unq 0 iso 0 dist 8.89433 8.39644 12.3975 3.43331 6.32455 9.207 numMergedOcc 0
20 mol 251 unq 1 iso 0 dist 8.89433 9.228 7.37036 9.59121 9.29007 14.9939 numMergedOcc 0
21 mol 251 unq 2 iso 0 dist 8.89433 7.4878 8.64172 9.59121 9.29007 14.5461 numMergedOcc 0
22 mol 259 unq 0 iso 0 dist 9.05363 8.06771 10.4985 6.95971 4.98888 11.5243 numMergedOcc 0
23 mol 292 unq 0 iso 0 dist 8.35169 9.64124 10.1669 11.6201 8.25719 17.7189 numMergedOcc 0
24 mol 292 unq 1 iso 0 dist 8.35169 9.30668 5.58251 11.6201 8.25719 13.4294 numMergedOcc 0
