0 mol 7 unq 0 iso 0 dist 9.49401 18.245 9.68596 14.1217 10.1841 9.87885 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 5.94245 5.88932 6.42748 10.8674 5.20798 8.85174 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.12171 10.5449 9.41441 13.7266 10.0453 7.95042 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 8.12171 14.617 6.73939 20.343 12.5545 6.6219 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 8.12171 14.617 6.73939 11.6677 4.08755 5.68215 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 8.80308 7.71984 5.93884 6.86485 5.66912 9.22598 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 8.80308 4.67517 7.68678 6.86485 5.66912 8.96727 numMergedOcc 0
7 mol 58 unq 2 iso 0 dist 8.80308 4.67517 7.68678 8.37546 5.76523 8.01308 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 9.45854 4.17348 7.52354 11.5632 4.52323 9.33861 numMergedOcc 0
9 mol 108 unq 0 iso 0 dist 8.50992 10.051 9.01852 15.6506 10.2851 7.93045 numMergedOcc 0
10 mol 108 unq 1 iso 0 dist 8.00008 15.8859 9.01852 18.1801 10.2851 7.93045 numMergedOcc 0
11 mol 108 unq 2 iso 0 dist 7.79698 14.7085 9.01852 16.9042 10.2851 7.93045 numMergedOcc 0
12 mol 108 unq 3 iso 0 dist 7.18748 4.56297 9.01852 10.4729 10.2851 7.93045 numMergedOcc 0
13 mol 113 unq 0 iso 0 dist 9.17878 6.46081 8.8822 13.228 7.1951 8.80934 numMergedOcc 0
14 mol 130 unq 0 iso 0 dist 8.65287 6.79537 9.99802 13.0221 10.3272 9.98797 numMergedOcc 0
15 mol 167 unq 0 iso 0 dist 9.83216 9.58044 9.67741 10.7263 5.43662 7.20495 numMergedOcc 0
16 mol 167 unq 1 iso 0 dist 9.83216 9.58044 9.67741 15.4481 8.91275 9.2289 numMergedOcc 0
17 mol 167 unq 2 iso 0 dist 9.83216 9.58044 9.67741 11.9625 5.95858 7.02548 numMergedOcc 0
18 mol 181 unq 0 iso 0 dist 8.83185 5.49497 5.94469 7.83476 4.98436 6.64173 numMergedOcc 0
19 mol 181 unq 1 iso 0 dist 8.83185 5.49497 5.94469 13.3652 11.9796 9.01624 numMergedOcc 0
20 mol 181 unq 2 iso 0 dist 8.83185 5.49497 5.94469 12.7598 12.3589 9.55105 numMergedOcc 0
21 mol 181 unq 3 iso 0 dist 9.0234 10.9813 5.94469 11.1968 4.98436 6.64173 numMergedOcc 0
22 mol 181 unq 4 iso 0 dist 9.0234 10.9813 5.94469 9.45579 11.9796 9.01624 numMergedOcc 0
23 mol 181 unq 5 iso 0 dist 9.0234 10.9813 5.94469 11.3781 12.3589 9.55105 numMergedOcc 0
24 mol 195 unq 0 iso 0 dist 9.3437 7.24106 6.95086 12.7263 5.60628 7.41662 numMergedOcc 0
25 mol 223 unq 0 iso 0 dist 8.73987 11.1577 7.48463 14.2021 10.5752 6.42257 numMergedOcc 0
26 mol 223 unq 1 iso 0 dist 8.73987 11.1577 7.48463 12.0216 3.86668 9.33543 numMergedOcc 0
27 mol 238 unq 0 iso 0 dist 6.62283 5.88384 9.24557 15.5159 17.1065 9.72188 numMergedOcc 0
