0 mol 20 unq 0 iso 0 dist 8.98326 11.5372 5.83917 11.2079 5.28474 5.9809 numMergedOcc 0
1 mol 21 unq 0 iso 0 dist 9.24767 5.40424 9.35562 13.2949 15.9052 8.63857 numMergedOcc 0
2 mol 39 unq 0 iso 0 dist 6.17708 6.16075 7.30265 10.4356 9.75478 8.94353 numMergedOcc 0
3 mol 67 unq 0 iso 0 dist 8.55809 4.94442 7.5228 12.6583 15.3956 8.96498 numMergedOcc 0
4 mol 72 unq 0 iso 0 dist 9.20886 5.94737 9.437 11.3204 5.75711 9.14817 numMergedOcc 0
5 mol 72 unq 1 iso 0 dist 9.20886 5.94737 9.437 12.3271 5.26077 9.76686 numMergedOcc 0
6 mol 72 unq 2 iso 0 dist 9.73435 12.1059 6.53824 18.985 9.85358 9.37102 numMergedOcc 0
7 mol 72 unq 3 iso 0 dist 9.73435 12.1059 6.53824 13.9281 4.85556 5.4605 numMergedOcc 0
8 mol 72 unq 4 iso 0 dist 9.73435 15.5148 7.67686 18.985 9.85358 8.8184 numMergedOcc 0
9 mol 72 unq 5 iso 0 dist 9.73435 15.5148 7.67686 13.9281 4.85556 6.1906 numMergedOcc 0
10 mol 72 unq 6 iso 0 dist 9.73435 15.5148 7.67686 12.4784 3.44489 8.70809 numMergedOcc 0
11 mol 95 unq 0 iso 0 dist 7.84956 6.33328 9.84457 10.6814 5.04906 9.51318 numMergedOcc 0
12 mol 98 unq 0 iso 0 dist 5.91797 4.34749 4.44979 6.37954 6.70343 6.61111 numMergedOcc 0
13 mol 98 unq 1 iso 0 dist 6.37954 4.34749 6.61111 5.91797 6.70343 4.44979 numMergedOcc 0
14 mol 134 unq 0 iso 0 dist 7.76446 5.2893 6.44575 6.14652 5.83782 7.43401 numMergedOcc 0
15 mol 134 unq 1 iso 0 dist 6.14652 5.2893 7.43401 7.76446 5.83782 6.44575 numMergedOcc 0
16 mol 173 unq 0 iso 0 dist 8.46046 5.5203 8.62366 11.8874 6.03503 9.44973 numMergedOcc 0
17 mol 173 unq 1 iso 0 dist 8.46046 5.5203 8.62366 7.48065 7.19559 6.52508 numMergedOcc 0
18 mol 173 unq 2 iso 0 dist 7.48065 5.5203 6.52508 8.46046 7.19559 8.62366 numMergedOcc 0
19 mol 173 unq 3 iso 0 dist 7.48065 5.5203 6.52508 11.8874 6.51246 9.44973 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 8.56943 9.68695 8.27411 15.538 15.1017 6.96257 numMergedOcc 0
