0 mol 7 unq 0 iso 0 dist 6.28925 6.81066 9.23292 9.68596 5.82034 14.3521 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 7.47838 7.39855 6.47454 9.47063 7.25546 6.96992 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 8.07369 9.80484 14.4423 8.64915 9.84125 12.643 numMergedOcc 0
3 mol 9 unq 2 iso 0 dist 8.07369 9.80484 14.4423 8.17347 6.12805 11.2964 numMergedOcc 0
4 mol 9 unq 3 iso 0 dist 8.07369 9.80484 14.4423 7.83133 6.78475 9.00843 numMergedOcc 0
5 mol 19 unq 0 iso 0 dist 7.97324 6.50337 8.58416 7.75618 10.3824 5.46754 numMergedOcc 0
6 mol 20 unq 0 iso 0 dist 9.8099 7.16149 7.34326 7.51452 5.095 3.61632 numMergedOcc 0
7 mol 20 unq 1 iso 0 dist 9.8099 7.16149 7.34326 6.03547 11.0764 4.32143 numMergedOcc 0
8 mol 62 unq 0 iso 0 dist 7.13406 9.854 13.2417 7.56205 9.89877 6.71999 numMergedOcc 0
9 mol 72 unq 0 iso 0 dist 8.96978 4.69674 9.32838 9.27838 10.2373 11.7291 numMergedOcc 0
10 mol 100 unq 0 iso 0 dist 4.5985 7.69401 7.7565 7.80975 4.71426 8.86956 numMergedOcc 0
11 mol 100 unq 1 iso 0 dist 4.5985 6.92671 7.03319 7.80975 4.71426 11.7384 numMergedOcc 0
12 mol 100 unq 2 iso 0 dist 8.20656 7.98814 4.49046 7.10378 4.71426 5.53567 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 6.52987 7.23959 12.8648 6.03688 7.69374 9.6084 numMergedOcc 0
14 mol 206 unq 0 iso 0 dist 4.90825 4.98125 3.49996 7.29285 7.77719 6.21429 numMergedOcc 0
15 mol 206 unq 1 iso 0 dist 5.52084 9.73419 14.8651 6.16414 9.78738 7.87274 numMergedOcc 0
16 mol 206 unq 2 iso 0 dist 5.52084 9.73419 14.8651 7.33701 7.21306 12.04 numMergedOcc 0
17 mol 206 unq 3 iso 0 dist 5.52084 9.73419 14.8651 8.0871 4.91529 15.182 numMergedOcc 0
18 mol 206 unq 4 iso 0 dist 5.52084 9.99824 10.2897 6.16414 9.78738 6.55611 numMergedOcc 0
19 mol 206 unq 5 iso 0 dist 5.52084 9.99824 10.2897 7.33701 7.21306 7.22859 numMergedOcc 0
20 mol 206 unq 6 iso 0 dist 5.52084 9.99824 10.2897 8.0871 4.91529 9.80396 numMergedOcc 0
21 mol 206 unq 7 iso 0 dist 6.20349 4.98125 4.92088 7.29285 9.33677 6.21429 numMergedOcc 0
22 mol 219 unq 0 iso 0 dist 5.40597 7.68645 4.07063 7.59632 9.99563 10.8057 numMergedOcc 0
23 mol 234 unq 0 iso 0 dist 7.27632 9.18589 7.13065 6.30154 12.1933 14.0878 numMergedOcc 0
24 mol 234 unq 1 iso 0 dist 7.27632 9.18589 7.13065 7.32499 5.20198 11.7131 numMergedOcc 0
25 mol 240 unq 0 iso 0 dist 7.55134 5.31041 7.70391 6.68687 10.9665 6.98179 numMergedOcc 0
26 mol 274 unq 0 iso 0 dist 6.92434 8.98154 6.14786 9.85289 4.67674 10.4158 numMergedOcc 0
27 mol 274 unq 1 iso 0 dist 6.93875 8.98154 10.2165 9.85289 14.1093 10.4158 numMergedOcc 0
28 mol 274 unq 2 iso 0 dist 6.0868 8.98154 13.692 9.85289 13.6948 10.4158 numMergedOcc 0
29 mol 274 unq 3 iso 0 dist 6.32856 8.98154 15.2936 9.85289 13.6849 10.4158 numMergedOcc 0
