0 mol 24 unq 0 iso 0 dist 9.97806 9.67926 6.17726 7.63824 7.33787 10.9551 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.32779 9.67926 6.51016 7.63824 5.43498 10.9551 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 8.38139 7.77714 5.24524 6.77802 5.7037 6.38985 numMergedOcc 0
3 mol 111 unq 0 iso 0 dist 5.68841 8.38367 4.53184 8.51084 3.83194 4.21801 numMergedOcc 0
4 mol 111 unq 1 iso 0 dist 5.68841 8.38367 4.53184 5.53271 5.56913 10.0002 numMergedOcc 0
5 mol 111 unq 2 iso 0 dist 5.68841 5.05141 6.48732 8.51084 3.83194 10.3018 numMergedOcc 0
6 mol 111 unq 3 iso 0 dist 5.68841 5.05141 6.48732 5.53271 5.56913 4.88926 numMergedOcc 0
7 mol 111 unq 4 iso 0 dist 5.68841 7.95205 5.25493 6.33923 7.42165 4.58626 numMergedOcc 0
8 mol 111 unq 5 iso 0 dist 5.68841 7.95205 5.25493 9.9801 7.93667 3.78254 numMergedOcc 0
9 mol 124 unq 0 iso 0 dist 7.24083 5.69775 9.35084 8.06631 6.49874 8.5036 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 9.1717 7.97262 13.5181 5.86693 6.8842 6.97119 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 8.8319 7.97262 9.03534 5.86693 5.05002 6.97119 numMergedOcc 0
12 mol 151 unq 0 iso 0 dist 8.1034 8.96469 9.10018 5.91643 5.81096 4.17025 numMergedOcc 0
13 mol 178 unq 0 iso 0 dist 7.55683 8.71294 11.9332 6.3472 8.84201 7.67657 numMergedOcc 0
14 mol 233 unq 0 iso 0 dist 6.28379 9.99681 12.6434 6.45095 5.74821 12.9722 numMergedOcc 0
15 mol 233 unq 1 iso 0 dist 9.29279 9.99681 10.3831 6.45095 11.8995 12.9722 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 9.64578 7.90449 16.8167 7.45508 9.1722 14.793 numMergedOcc 0
17 mol 239 unq 1 iso 0 dist 9.64578 7.90449 16.8167 5.79883 11.457 7.07666 numMergedOcc 0
18 mol 239 unq 2 iso 0 dist 7.02833 7.90449 10.7857 7.45508 11.2097 14.793 numMergedOcc 0
19 mol 239 unq 3 iso 0 dist 7.02833 7.90449 10.7857 5.79883 6.10489 7.07666 numMergedOcc 0
20 mol 294 unq 0 iso 0 dist 8.63523 6.6112 4.35029 8.65363 14.0395 9.89492 numMergedOcc 0
21 mol 294 unq 1 iso 0 dist 8.63523 6.6112 4.35029 6.44588 9.96893 5.71856 numMergedOcc 0
22 mol 294 unq 2 iso 0 dist 8.63523 8.34193 9.73381 8.65363 14.0395 9.32362 numMergedOcc 0
23 mol 294 unq 3 iso 0 dist 8.63523 8.34193 9.73381 6.44588 9.96893 8.52592 numMergedOcc 0
24 mol 294 unq 4 iso 0 dist 8.63523 8.35722 14.2745 8.65363 14.0395 4.45227 numMergedOcc 0
25 mol 294 unq 5 iso 0 dist 8.63523 8.35722 14.2745 6.44588 9.96893 4.99494 numMergedOcc 0
