0 mol 46 unq 0 iso 0 dist 5.02642 7.57749 3.66253 6.70122 6.02472 5.43693 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 9.14072 5.41774 4.55422 13.7632 9.16212 10.9319 numMergedOcc 0
2 mol 75 unq 0 iso 0 dist 5.47459 9.54377 10.0325 6.71593 9.04661 16.2235 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 5.55798 8.59739 5.71097 6.04435 5.33546 10.8203 numMergedOcc 0
4 mol 129 unq 0 iso 0 dist 5.16531 6.53559 9.54936 7.03404 6.52844 10.9495 numMergedOcc 0
5 mol 129 unq 1 iso 0 dist 5.16531 7.90844 9.63929 7.03404 6.52844 14.5783 numMergedOcc 0
6 mol 129 unq 2 iso 0 dist 6.65878 8.09774 6.31483 6.15789 9.7113 6.34626 numMergedOcc 0
7 mol 146 unq 0 iso 0 dist 6.14952 8.43651 4.70365 6.27901 6.47434 9.23136 numMergedOcc 0
8 mol 146 unq 1 iso 0 dist 6.14952 9.79573 3.82933 6.27901 6.47434 9.80776 numMergedOcc 0
9 mol 154 unq 0 iso 0 dist 8.65008 5.06116 7.59527 9.10645 8.60004 8.71789 numMergedOcc 0
10 mol 169 unq 0 iso 0 dist 6.09291 6.00783 7.58935 8.92988 5.82321 10.034 numMergedOcc 0
11 mol 169 unq 1 iso 0 dist 9.90583 8.54444 6.49048 6.9276 5.82321 6.05009 numMergedOcc 0
12 mol 192 unq 0 iso 0 dist 9.78743 7.93715 13.2141 7.02086 8.29166 13.9144 numMergedOcc 0
13 mol 192 unq 1 iso 0 dist 9.78743 7.93715 13.2141 14.0195 8.14859 12.9788 numMergedOcc 0
14 mol 192 unq 2 iso 0 dist 9.78743 7.93715 13.2141 11.153 5.62421 12.3002 numMergedOcc 0
15 mol 212 unq 0 iso 0 dist 8.09185 5.03184 7.52135 9.39384 6.80332 12.0526 numMergedOcc 0
16 mol 212 unq 1 iso 0 dist 8.09185 5.03184 7.52135 5.94698 7.64336 9.32123 numMergedOcc 0
17 mol 233 unq 0 iso 0 dist 7.20629 8.84037 3.80398 5.30641 6.85515 10.0578 numMergedOcc 0
18 mol 233 unq 1 iso 0 dist 6.5622 8.84037 5.62929 5.30641 9.37999 10.0578 numMergedOcc 0
19 mol 233 unq 2 iso 0 dist 9.44671 5.76164 7.87864 8.39532 6.85515 10.7974 numMergedOcc 0
