0 mol 1 unq 0 iso 0 dist 8.93702 11.8064 9.44115 13.8284 5.972 8.61411 numMergedOcc 0
1 mol 92 unq 0 iso 0 dist 6.97484 8.99211 7.00606 8.79798 4.98716 6.59382 numMergedOcc 0
2 mol 100 unq 0 iso 0 dist 9.9443 13.1946 7.90328 11.3135 5.07584 6.97361 numMergedOcc 0
3 mol 100 unq 1 iso 0 dist 9.9443 13.1946 7.90328 16.5387 7.59628 8.52125 numMergedOcc 0
4 mol 143 unq 0 iso 0 dist 7.13287 10.559 9.9492 8.32453 6.50232 5.46716 numMergedOcc 0
5 mol 148 unq 0 iso 0 dist 6.91289 11.075 8.07915 13.2368 6.94302 6.60739 numMergedOcc 0
6 mol 148 unq 1 iso 0 dist 6.91289 11.075 8.07915 17.6782 12.3565 9.22427 numMergedOcc 0
7 mol 148 unq 2 iso 0 dist 6.91289 11.075 8.07915 9.3072 5.58057 5.55129 numMergedOcc 0
8 mol 150 unq 0 iso 0 dist 6.895 10.4943 7.97801 12.9224 6.83379 6.71763 numMergedOcc 0
9 mol 150 unq 1 iso 0 dist 6.895 10.4943 7.97801 17.557 12.2713 9.32504 numMergedOcc 0
10 mol 150 unq 2 iso 0 dist 6.895 10.4943 7.97801 8.78461 5.55906 5.53778 numMergedOcc 0
11 mol 197 unq 0 iso 0 dist 6.58245 11.5081 8.32685 10.2956 5.92782 6.50727 numMergedOcc 0
12 mol 197 unq 1 iso 0 dist 6.58245 11.8158 6.74777 10.2956 5.92782 7.84826 numMergedOcc 0
13 mol 197 unq 2 iso 0 dist 6.58245 14.0335 9.62514 12.7699 10.1284 7.56537 numMergedOcc 0
14 mol 197 unq 3 iso 0 dist 6.58245 14.0335 9.62514 19.9254 16.3081 9.89975 numMergedOcc 0
15 mol 212 unq 0 iso 0 dist 6.11919 5.23162 9.15316 8.88323 5.8232 9.89938 numMergedOcc 0
16 mol 226 unq 0 iso 0 dist 9.51038 5.70516 9.31669 11.2469 6.05562 8.10096 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 6.06804 5.18467 8.82471 7.60093 6.07589 6.14732 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 9.07397 16.8 9.46582 14.7046 6.23871 9.46728 numMergedOcc 0
19 mol 238 unq 1 iso 0 dist 8.91763 4.74813 9.46582 10.6266 6.23871 9.46728 numMergedOcc 0
20 mol 238 unq 2 iso 0 dist 6.62086 4.74813 9.77231 10.6266 10.1372 9.46728 numMergedOcc 0
21 mol 238 unq 3 iso 0 dist 6.50118 10.0091 9.77231 15.0542 10.1372 9.46728 numMergedOcc 0
22 mol 274 unq 0 iso 0 dist 8.8896 6.59723 8.62431 11.2274 4.05661 8.26851 numMergedOcc 0
23 mol 274 unq 1 iso 0 dist 8.8896 6.59723 8.62431 12.41 7.47324 8.14634 numMergedOcc 0
