0 mol 20 unq 0 iso 0 dist 7.67558 7.5037 4.15066 7.33632 7.9193 9.60039 numMergedOcc 0
1 mol 90 unq 0 iso 0 dist 8.09741 5.95873 8.91055 4.48773 6.81831 9.56911 numMergedOcc 0
2 mol 98 unq 0 iso 0 dist 7.7946 6.80592 4.3761 13.7585 6.41542 8.04448 numMergedOcc 0
3 mol 99 unq 0 iso 0 dist 8.25469 11.721 5.64099 11.4647 5.91888 7.09617 numMergedOcc 0
4 mol 113 unq 0 iso 0 dist 8.50734 7.6087 9.04398 12.1661 5.73195 8.68123 numMergedOcc 0
5 mol 180 unq 0 iso 0 dist 7.54921 4.10999 6.33325 9.85529 3.72291 9.26812 numMergedOcc 0
6 mol 209 unq 0 iso 0 dist 8.10644 6.24493 9.53923 11.948 6.61665 9.39076 numMergedOcc 0
7 mol 238 unq 0 iso 0 dist 8.81381 10.5679 9.77491 16.6369 10.1351 9.18345 numMergedOcc 0
8 mol 239 unq 0 iso 0 dist 9.91899 15.8248 7.45786 14.3652 11.9127 9.87224 numMergedOcc 0
9 mol 239 unq 1 iso 0 dist 7.69106 13.3656 7.45786 18.5133 11.9127 9.87224 numMergedOcc 0
10 mol 260 unq 0 iso 0 dist 7.5129 13.8952 8.79012 18.1935 12.4464 6.23198 numMergedOcc 0
