0 mol 6 unq 0 iso 0 dist 8.41625 9.27862 10.6457 6.01633 4.82562 12.4886 numMergedOcc 0
1 mol 6 unq 1 iso 0 dist 8.41625 6.17194 10.9641 6.01633 4.82562 10.9921 numMergedOcc 0
2 mol 6 unq 2 iso 0 dist 9.26453 9.27862 11.6246 6.01633 8.85796 12.4886 numMergedOcc 0
3 mol 6 unq 3 iso 0 dist 9.26453 6.17194 12.7951 6.01633 8.85796 10.9921 numMergedOcc 0
4 mol 10 unq 0 iso 0 dist 9.48775 9.57652 5.07222 13.0084 8.16906 12.9969 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 4.78749 5.42968 10.0962 4.30555 5.65754 8.25818 numMergedOcc 0
6 mol 24 unq 1 iso 0 dist 4.78749 5.94343 8.56474 4.30555 5.65754 10.2171 numMergedOcc 0
7 mol 62 unq 0 iso 0 dist 6.09042 8.32519 7.31044 9.29792 7.61377 12.5231 numMergedOcc 0
8 mol 69 unq 0 iso 0 dist 8.32033 5.38363 4.08651 12.3183 9.38568 10.614 numMergedOcc 0
9 mol 78 unq 0 iso 0 dist 9.93275 9.9934 8.68247 9.62606 6.11101 11.7064 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 8.98532 7.06722 10.8271 12.2432 6.61645 16.5728 numMergedOcc 0
11 mol 95 unq 0 iso 0 dist 5.84349 8.6356 7.78168 6.56529 9.02905 10.6299 numMergedOcc 0
12 mol 98 unq 0 iso 0 dist 7.29309 5.58102 7.22521 4.77009 9.45257 6.5816 numMergedOcc 0
13 mol 102 unq 0 iso 0 dist 7.90927 9.00369 12.4961 13.541 9.51771 18.025 numMergedOcc 0
14 mol 195 unq 0 iso 0 dist 8.3941 9.33055 16.9491 5.77195 9.16422 14.056 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 6.58174 8.47283 9.88337 10.816 8.77524 9.93489 numMergedOcc 0
16 mol 214 unq 0 iso 0 dist 7.24175 7.93054 9.84398 7.25055 9.46274 14.3357 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 8.33143 8.81424 10.8002 16.0567 7.78392 16.6974 numMergedOcc 0
18 mol 225 unq 1 iso 0 dist 8.33143 9.60949 16.2766 16.0567 7.78392 22.9982 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 6.20998 7.96613 12.2408 6.80038 7.36137 7.8598 numMergedOcc 0
20 mol 266 unq 1 iso 0 dist 6.20998 7.96613 12.2408 4.5731 4.95415 7.80711 numMergedOcc 0
21 mol 266 unq 2 iso 0 dist 8.78219 7.96613 5.34431 6.80038 6.83784 7.8598 numMergedOcc 0
22 mol 266 unq 3 iso 0 dist 8.78219 7.96613 5.34431 4.5731 6.38519 7.80711 numMergedOcc 0
23 mol 285 unq 0 iso 0 dist 4.49395 5.93983 4.57431 5.32175 7.08681 8.80238 numMergedOcc 0
24 mol 285 unq 1 iso 0 dist 4.49395 5.93983 4.57431 8.32005 4.95596 5.88958 numMergedOcc 0
25 mol 285 unq 2 iso 0 dist 4.49395 5.93983 4.57431 7.07384 6.3508 7.78121 numMergedOcc 0
26 mol 285 unq 3 iso 0 dist 4.49395 5.93983 4.57431 12.2276 8.3005 11.6117 numMergedOcc 0
