0 mol 34 unq 0 iso 0 dist 7.59353 4.36931 9.26362 7.30954 7.05327 6.58698 numMergedOcc 0
1 mol 34 unq 0 iso 1 dist 7.59353 7.30954 7.05327 4.36931 9.26362 6.58698 numMergedOcc 0
2 mol 90 unq 0 iso 0 dist 8.79724 11.6646 6.18681 11.9169 9.33288 5.0846 numMergedOcc 0
3 mol 90 unq 0 iso 1 dist 8.79724 11.9169 9.33288 11.6646 6.18681 5.0846 numMergedOcc 0
4 mol 113 unq 0 iso 0 dist 8.55666 8.60758 5.45882 7.49297 4.57487 3.74304 numMergedOcc 0
5 mol 113 unq 0 iso 1 dist 8.55666 7.49297 4.57487 8.60758 5.45882 3.74304 numMergedOcc 0
6 mol 113 unq 1 iso 0 dist 8.45284 5.85846 5.45882 5.23629 4.57487 3.74304 numMergedOcc 0
7 mol 113 unq 1 iso 1 dist 8.45284 5.23629 4.57487 5.85846 5.45882 3.74304 numMergedOcc 0
8 mol 113 unq 2 iso 0 dist 7.77845 10.3632 5.45882 9.86085 4.57487 3.74304 numMergedOcc 0
9 mol 113 unq 2 iso 1 dist 7.77845 9.86085 4.57487 10.3632 5.45882 3.74304 numMergedOcc 0
10 mol 113 unq 3 iso 0 dist 9.43828 14.0625 5.45882 11.2311 4.57487 3.74304 numMergedOcc 0
11 mol 113 unq 3 iso 1 dist 9.43828 11.2311 4.57487 14.0625 5.45882 3.74304 numMergedOcc 0
12 mol 147 unq 0 iso 0 dist 7.88785 5.76262 9.23589 4.09924 9.22196 3.6066 numMergedOcc 0
13 mol 147 unq 0 iso 1 dist 7.88785 4.09924 9.22196 5.76262 9.23589 3.6066 numMergedOcc 0
14 mol 197 unq 0 iso 0 dist 9.47487 11.3271 9.6071 15.4113 9.77656 9.2162 numMergedOcc 0
15 mol 197 unq 0 iso 1 dist 9.47487 15.4113 9.77656 11.3271 9.6071 9.2162 numMergedOcc 0
16 mol 212 unq 0 iso 0 dist 6.80916 5.15503 6.07371 4.15106 7.98532 3.62594 numMergedOcc 0
17 mol 212 unq 0 iso 1 dist 6.80916 4.15106 7.98532 5.15503 6.07371 3.62594 numMergedOcc 0
18 mol 264 unq 0 iso 0 dist 6.61098 11.3526 8.56867 8.93485 6.29872 2.95376 numMergedOcc 0
19 mol 264 unq 0 iso 1 dist 6.61098 8.93485 6.29872 11.3526 8.56867 2.95376 numMergedOcc 0
20 mol 264 unq 1 iso 0 dist 6.25794 6.26054 8.56867 3.81537 6.29872 2.95376 numMergedOcc 0
21 mol 264 unq 1 iso 1 dist 6.25794 3.81537 6.29872 6.26054 8.56867 2.95376 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 9.99897 5.6513 7.77225 9.53574 5.50067 9.30266 numMergedOcc 0
23 mol 287 unq 0 iso 1 dist 9.99897 9.53574 5.50067 5.6513 7.77225 9.30266 numMergedOcc 0
24 mol 288 unq 0 iso 0 dist 9.99897 5.6513 7.77225 9.53574 5.50067 9.30266 numMergedOcc 0
25 mol 288 unq 0 iso 1 dist 9.99897 9.53574 5.50067 5.6513 7.77225 9.30266 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 9.99897 5.6513 7.77225 9.53574 5.50067 9.30266 numMergedOcc 0
27 mol 289 unq 0 iso 1 dist 9.99897 9.53574 5.50067 5.6513 7.77225 9.30266 numMergedOcc 0
