0 mol 32 unq 0 iso 0 dist 6.86352 8.08867 9.5209 12.3286 9.26879 7.11053 numMergedOcc 0
1 mol 32 unq 1 iso 0 dist 8.5448 5.91961 9.5209 11.5166 9.26879 7.11053 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 7.77613 6.68767 9.4815 7.61802 10.4158 5.91068 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 9.43268 4.70344 6.5784 10.2461 5.51402 5.64432 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 8.68096 11.2024 8.42365 5.40287 3.73561 9.68228 numMergedOcc 0
5 mol 117 unq 0 iso 0 dist 6.98104 11.6272 9.77482 15.6502 11.119 9.94053 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 8.59967 6.60331 6.77398 9.27304 5.90154 5.06715 numMergedOcc 0
7 mol 134 unq 1 iso 0 dist 8.59967 12.2305 5.68207 9.27304 5.90154 6.68164 numMergedOcc 0
8 mol 134 unq 2 iso 0 dist 5.79433 5.76685 6.33375 11.1317 9.88169 5.73203 numMergedOcc 0
9 mol 134 unq 3 iso 0 dist 5.79433 5.76685 6.33375 10.7457 11.8593 6.57379 numMergedOcc 0
10 mol 134 unq 4 iso 0 dist 5.79433 6.60331 8.06229 9.27304 9.40104 5.06715 numMergedOcc 0
11 mol 146 unq 0 iso 0 dist 8.64781 11.995 6.66451 8.82192 3.75935 5.41078 numMergedOcc 0
12 mol 213 unq 0 iso 0 dist 8.22702 12.2431 8.6925 13.4355 6.49084 5.461 numMergedOcc 0
13 mol 233 unq 0 iso 0 dist 8.08007 4.43794 7.40764 11.2143 5.47357 8.24424 numMergedOcc 0
14 mol 233 unq 1 iso 0 dist 8.08007 4.43794 7.40764 10.1504 5.47592 7.0942 numMergedOcc 0
15 mol 233 unq 2 iso 0 dist 8.08007 4.43794 7.40764 5.29501 3.67394 6.01775 numMergedOcc 0
16 mol 234 unq 0 iso 0 dist 6.8314 6.47584 6.553 11.3427 4.84686 9.11572 numMergedOcc 0
17 mol 267 unq 0 iso 0 dist 8.41273 7.37981 6.60591 8.04091 11.9524 6.32877 numMergedOcc 0
18 mol 267 unq 1 iso 0 dist 8.41273 7.37981 6.60591 13.2996 14.5766 9.48115 numMergedOcc 0
19 mol 267 unq 2 iso 0 dist 8.41273 7.37981 6.60591 12.2265 6.09744 8.38545 numMergedOcc 0
20 mol 267 unq 3 iso 0 dist 8.41273 7.37981 6.60591 10.6588 5.40798 5.08174 numMergedOcc 0
21 mol 267 unq 4 iso 0 dist 8.41273 7.37981 6.60591 12.5562 6.6853 6.10838 numMergedOcc 0
