0 mol 1 unq 0 iso 0 dist 8.10712 9.40282 14.5115 8.65442 9.22477 18.0225 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.10712 9.35554 5.59021 8.65442 9.22477 12.0944 numMergedOcc 0
2 mol 14 unq 0 iso 0 dist 6.3453 8.64855 11.0036 6.00565 7.98958 12.5842 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.34433 6.84521 12.3867 11.2615 5.63207 16.2186 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 9.34433 8.90024 12.0037 11.2615 5.63207 15.4814 numMergedOcc 0
5 mol 43 unq 2 iso 0 dist 9.34433 6.78532 6.9067 11.2615 5.63207 11.6685 numMergedOcc 0
6 mol 43 unq 3 iso 0 dist 5.63207 6.35333 5.90331 11.2615 9.34433 15.0477 numMergedOcc 0
7 mol 70 unq 0 iso 0 dist 6.538 8.63742 6.39257 5.54632 9.26484 6.91739 numMergedOcc 0
8 mol 70 unq 1 iso 0 dist 9.26484 8.30653 11.3192 5.54632 6.538 11.7974 numMergedOcc 0
9 mol 70 unq 2 iso 0 dist 9.26484 6.91739 6.39257 5.54632 6.538 8.63742 numMergedOcc 0
10 mol 128 unq 0 iso 0 dist 8.20904 8.3127 11.1747 8.92267 9.82711 10.7055 numMergedOcc 0
11 mol 128 unq 1 iso 0 dist 8.20904 8.3127 11.1747 8.3686 5.96435 13.5161 numMergedOcc 0
12 mol 227 unq 0 iso 0 dist 8.25412 9.66521 5.14019 7.78988 8.32703 10.4039 numMergedOcc 0
13 mol 236 unq 0 iso 0 dist 5.46484 8.95071 6.49831 12.2836 8.80671 12.8768 numMergedOcc 0
14 mol 236 unq 1 iso 0 dist 8.80671 7.49412 6.81625 12.2836 5.46484 11.2107 numMergedOcc 0
15 mol 252 unq 0 iso 0 dist 5.41885 7.91348 5.96471 6.25256 9.4344 10.9853 numMergedOcc 0
16 mol 280 unq 0 iso 0 dist 8.64546 6.94723 6.0971 6.2679 3.97964 6.52188 numMergedOcc 0
17 mol 280 unq 1 iso 0 dist 3.97964 6.52188 6.0971 6.2679 8.64546 6.94723 numMergedOcc 0
18 mol 280 unq 2 iso 0 dist 4.55639 6.94723 6.96139 6.2679 7.72152 6.52188 numMergedOcc 0
19 mol 280 unq 3 iso 0 dist 7.72152 6.52188 6.96139 6.2679 4.55639 6.94723 numMergedOcc 0
20 mol 281 unq 0 iso 0 dist 6.81536 9.37845 5.81338 10.6899 9.89425 15.5545 numMergedOcc 0
