0 mol 70 unq 0 iso 0 dist 6.95632 10.653 8.60535 15.6561 10.0384 9.79317 numMergedOcc 0
1 mol 70 unq 1 iso 0 dist 6.95632 10.653 8.60535 12.0244 6.36433 7.69436 numMergedOcc 0
2 mol 88 unq 0 iso 0 dist 7.88897 8.38946 6.85867 15.5335 9.33803 8.56269 numMergedOcc 0
3 mol 88 unq 1 iso 0 dist 7.88897 8.38946 6.85867 8.84468 5.46401 9.40699 numMergedOcc 0
4 mol 93 unq 0 iso 0 dist 8.10296 7.74883 7.4518 9.90891 4.34681 5.10693 numMergedOcc 0
5 mol 93 unq 1 iso 0 dist 8.10296 7.74883 7.4518 11.3409 5.73248 6.58814 numMergedOcc 0
6 mol 93 unq 2 iso 0 dist 8.10296 7.74883 7.4518 11.7034 13.5809 6.13459 numMergedOcc 0
7 mol 93 unq 3 iso 0 dist 8.10296 7.74883 7.4518 14.3946 14.149 7.54391 numMergedOcc 0
8 mol 109 unq 0 iso 0 dist 8.06147 10.633 8.48774 10.7303 4.0719 6.3323 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 6.25088 9.36148 9.66068 7.98399 6.29259 7.96893 numMergedOcc 0
10 mol 113 unq 1 iso 0 dist 8.23837 13.1071 5.37302 9.72242 3.52111 7.08403 numMergedOcc 0
11 mol 113 unq 2 iso 0 dist 8.23837 9.36148 8.03783 7.98399 8.17309 7.96893 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 9.34662 9.61802 6.72323 9.74551 12.7291 8.52036 numMergedOcc 0
13 mol 169 unq 0 iso 0 dist 8.36806 13.1573 5.51388 10.3314 3.83687 7.33643 numMergedOcc 0
14 mol 169 unq 1 iso 0 dist 8.36806 9.19866 8.17917 7.5669 7.83748 7.78577 numMergedOcc 0
15 mol 180 unq 0 iso 0 dist 9.43939 3.92824 9.54753 10.1657 9.19793 6.91244 numMergedOcc 0
16 mol 222 unq 0 iso 0 dist 6.42875 7.03763 9.32543 8.55981 7.99695 4.90656 numMergedOcc 0
17 mol 253 unq 0 iso 0 dist 9.9453 14.3861 9.34735 15.0532 6.06804 8.71119 numMergedOcc 0
18 mol 253 unq 1 iso 0 dist 9.9453 14.3861 9.34735 15.6296 8.66074 6.21648 numMergedOcc 0
19 mol 253 unq 2 iso 0 dist 5.93986 4.92131 9.34735 8.15394 6.06804 8.71119 numMergedOcc 0
20 mol 253 unq 3 iso 0 dist 5.93986 4.92131 9.34735 7.66658 8.66074 6.21648 numMergedOcc 0
21 mol 268 unq 0 iso 0 dist 7.36234 13.6968 8.6745 10.8081 3.75857 6.18877 numMergedOcc 0
22 mol 268 unq 1 iso 0 dist 9.9425 4.51589 8.6745 7.93928 3.75857 6.18877 numMergedOcc 0
