0 mol 21 unq 0 iso 0 dist 8.07914 5.0018 3.91407 13.3153 10.6914 9.42165 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 5.85737 9.21068 9.47657 4.49191 9.99905 9.68362 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 7.50258 5.94216 11.6887 6.31736 12.5611 6.27204 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 8.84944 6.65308 6.77798 4.64937 5.51659 6.95457 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 8.90896 7.55565 6.51072 8.49428 11.8778 8.47208 numMergedOcc 0
5 mol 127 unq 0 iso 0 dist 5.83719 7.34368 4.49551 9.81852 9.62885 7.33646 numMergedOcc 0
6 mol 132 unq 0 iso 0 dist 6.94745 9.77766 12.0828 5.6296 10.1299 7.17412 numMergedOcc 0
7 mol 132 unq 1 iso 0 dist 6.94745 9.11314 10.2787 5.6296 10.1299 5.69956 numMergedOcc 0
8 mol 152 unq 0 iso 0 dist 9.65031 6.83034 6.41178 5.05633 6.89622 7.88147 numMergedOcc 0
9 mol 165 unq 0 iso 0 dist 6.85551 4.46402 8.22717 9.78341 14.9361 6.78432 numMergedOcc 0
10 mol 175 unq 0 iso 0 dist 7.30813 9.11753 4.71126 4.81365 5.25888 9.25721 numMergedOcc 0
11 mol 182 unq 0 iso 0 dist 8.27913 9.96156 6.2072 4.39505 8.63031 9.72584 numMergedOcc 0
12 mol 182 unq 1 iso 0 dist 6.38335 9.80892 6.2072 13.728 8.63031 9.72584 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 9.42047 5.99766 9.82099 7.54538 12.4229 5.71819 numMergedOcc 0
14 mol 206 unq 1 iso 0 dist 9.42047 5.99766 9.82099 4.85877 8.75124 8.48679 numMergedOcc 0
15 mol 206 unq 2 iso 0 dist 9.42047 5.99766 9.82099 6.8664 12.9727 9.86924 numMergedOcc 0
16 mol 206 unq 3 iso 0 dist 9.42047 5.99766 9.82099 8.77652 13.7429 7.44186 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 6.39087 9.55264 12.8065 11.8854 12.8507 5.05353 numMergedOcc 0
18 mol 265 unq 0 iso 0 dist 7.52632 7.29987 6.85532 5.57706 9.74602 5.8374 numMergedOcc 0
19 mol 281 unq 0 iso 0 dist 7.65321 5.46236 8.82508 11.1081 15.9251 9.55134 numMergedOcc 0
20 mol 284 unq 0 iso 0 dist 7.66585 9.51324 10.5265 5.09231 11.8011 8.22365 numMergedOcc 0
