0 mol 42 unq 0 iso 0 dist 9.82637 8.7885 12.7112 9.37073 9.29873 13.4401 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 7.51978 7.18148 13.8618 13.323 6.59893 18.259 numMergedOcc 0
2 mol 54 unq 1 iso 0 dist 7.51978 7.18148 13.8618 10.6593 5.59773 15.3713 numMergedOcc 0
3 mol 176 unq 0 iso 0 dist 4.96326 7.02812 5.02061 12.8098 9.03194 12.9211 numMergedOcc 0
4 mol 198 unq 0 iso 0 dist 5.80867 7.48253 4.27652 10.1488 6.47339 9.48314 numMergedOcc 0
5 mol 198 unq 1 iso 0 dist 9.4363 6.13687 4.27652 12.8945 6.47339 9.48314 numMergedOcc 0
6 mol 213 unq 0 iso 0 dist 6.82881 7.86605 3.62097 10.3239 4.58599 6.81437 numMergedOcc 0
7 mol 213 unq 1 iso 0 dist 6.82881 7.86605 3.62097 11.0972 8.78568 12.1379 numMergedOcc 0
8 mol 238 unq 0 iso 0 dist 7.80166 9.59909 14.2741 11.1397 9.31417 20.2557 numMergedOcc 0
9 mol 238 unq 1 iso 0 dist 7.80166 9.59909 14.2741 8.53461 5.56719 16.5443 numMergedOcc 0
10 mol 249 unq 0 iso 0 dist 6.93507 6.32658 5.57138 6.06312 5.78121 9.38713 numMergedOcc 0
11 mol 249 unq 1 iso 0 dist 6.42827 6.32658 10.3504 6.06312 7.29898 9.38713 numMergedOcc 0
12 mol 249 unq 2 iso 0 dist 6.42827 6.32658 10.3504 10.3054 8.91685 14.5497 numMergedOcc 0
13 mol 253 unq 0 iso 0 dist 5.76077 8.86676 9.46115 8.19585 7.7993 10.8796 numMergedOcc 0
14 mol 253 unq 1 iso 0 dist 5.76077 8.86676 9.46115 6.8205 6.10761 14.3387 numMergedOcc 0
15 mol 282 unq 0 iso 0 dist 6.65024 9.02882 4.50378 3.7513 9.12049 10.126 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 7.28096 6.17759 7.83168 5.75946 9.6331 11.5985 numMergedOcc 0
17 mol 287 unq 1 iso 0 dist 7.28096 8.20391 10.0322 5.75946 9.6331 12.3171 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 7.28096 6.17759 7.83168 5.75946 9.6331 11.5985 numMergedOcc 0
19 mol 288 unq 1 iso 0 dist 7.28096 8.20391 10.0322 5.75946 9.6331 12.3171 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 7.28096 6.17759 7.83168 5.75946 9.6331 11.5985 numMergedOcc 0
21 mol 289 unq 1 iso 0 dist 7.28096 8.20391 10.0322 5.75946 9.6331 12.3171 numMergedOcc 0
