0 mol 1 unq 0 iso 0 dist 8.61411 9.44115 5.972 9.76602 10.4951 13.7976 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.61411 9.44115 5.972 8.54314 9.49258 10.9135 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 7.99404 8.95503 5.30796 8.44864 8.76488 9.3581 numMergedOcc 0
3 mol 65 unq 0 iso 0 dist 9.06948 8.56202 7.15449 8.65898 5.02863 7.42963 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 6.59382 7.00606 4.98716 5.59552 4.7483 4.62893 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 5.28955 9.47892 8.00732 8.75431 5.01597 4.48922 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 9.31907 8.9344 6.8965 7.31633 10.1546 6.27692 numMergedOcc 0
7 mol 148 unq 0 iso 0 dist 6.60739 8.07915 6.94302 9.80819 12.193 16.3259 numMergedOcc 0
8 mol 148 unq 1 iso 0 dist 9.22427 8.07915 12.3565 9.80819 14.6053 16.3259 numMergedOcc 0
9 mol 148 unq 2 iso 0 dist 5.55129 8.07915 5.58057 9.80819 11.2269 16.3259 numMergedOcc 0
10 mol 150 unq 0 iso 0 dist 6.71763 7.97801 6.83379 9.81665 12.1772 16.2236 numMergedOcc 0
11 mol 150 unq 1 iso 0 dist 9.32504 7.97801 12.2713 9.81665 14.5231 16.2236 numMergedOcc 0
12 mol 150 unq 2 iso 0 dist 5.53778 7.97801 5.55906 9.81665 11.1674 16.2236 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 6.13872 8.45395 9.80135 5.66363 9.21613 4.43678 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 6.13872 5.41368 4.97806 5.66363 9.21613 6.03415 numMergedOcc 0
15 mol 197 unq 0 iso 0 dist 7.84826 6.74777 5.92782 7.40027 7.07515 4.59269 numMergedOcc 0
16 mol 197 unq 1 iso 0 dist 7.56537 9.62514 10.1284 8.98598 4.91904 11.1666 numMergedOcc 0
17 mol 197 unq 2 iso 0 dist 7.56537 9.62514 10.1284 7.06689 7.59634 13.3562 numMergedOcc 0
18 mol 197 unq 3 iso 0 dist 7.56537 9.62514 10.1284 9.69601 10.3181 4.59269 numMergedOcc 0
19 mol 197 unq 4 iso 0 dist 9.89975 9.62514 16.3081 8.98598 6.79468 11.1666 numMergedOcc 0
20 mol 197 unq 5 iso 0 dist 9.89975 9.62514 16.3081 7.06689 5.31205 13.3562 numMergedOcc 0
21 mol 197 unq 6 iso 0 dist 9.89975 9.62514 16.3081 9.69601 15.0675 4.59269 numMergedOcc 0
22 mol 226 unq 0 iso 0 dist 8.10096 9.31669 6.05562 7.04477 7.93097 10.9418 numMergedOcc 0
23 mol 274 unq 0 iso 0 dist 8.26851 8.62431 4.05661 9.11072 16.1916 17.5774 numMergedOcc 0
24 mol 274 unq 1 iso 0 dist 8.26851 8.62431 4.05661 6.83113 10.6481 11.0599 numMergedOcc 0
25 mol 274 unq 2 iso 0 dist 8.26851 8.62431 4.05661 9.44134 16.3797 15.961 numMergedOcc 0
26 mol 274 unq 3 iso 0 dist 8.14634 8.62431 7.47324 9.11072 14.7933 17.5774 numMergedOcc 0
27 mol 274 unq 4 iso 0 dist 8.14634 8.62431 7.47324 6.83113 7.09841 11.0599 numMergedOcc 0
28 mol 274 unq 5 iso 0 dist 8.14634 8.62431 7.47324 9.44134 13.8495 15.961 numMergedOcc 0
