0 mol 68 unq 0 iso 0 dist 6.6606 12.2255 9.93344 5.6194 7.9814 7.61116 numMergedOcc 0
1 mol 98 unq 0 iso 0 dist 6.9538 9.5165 7.38759 6.51921 7.32289 7.44829 numMergedOcc 0
2 mol 112 unq 0 iso 0 dist 7.65229 12.9793 6.85381 12.468 8.729 4.26804 numMergedOcc 0
3 mol 114 unq 0 iso 0 dist 5.87387 5.6579 8.42445 11.3694 6.34525 10.9798 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 8.59784 6.69727 9.42766 12.9632 8.56342 16.5854 numMergedOcc 0
5 mol 119 unq 1 iso 0 dist 8.59784 6.69727 9.42766 4.31572 6.37542 9.58167 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 4.93035 3.71857 6.42756 5.74529 6.69515 8.81081 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 5.63906 9.72967 7.66381 8.39509 9.83476 12.2047 numMergedOcc 0
8 mol 186 unq 1 iso 0 dist 5.63906 9.72967 7.66381 6.91649 6.258 5.77691 numMergedOcc 0
9 mol 198 unq 0 iso 0 dist 5.80867 10.1488 6.47339 11.1573 8.10985 10.1932 numMergedOcc 0
10 mol 198 unq 1 iso 0 dist 9.4363 12.8945 6.47339 4.75457 8.10985 10.1932 numMergedOcc 0
11 mol 214 unq 0 iso 0 dist 6.83122 12.2514 8.49704 8.62938 6.38157 5.20422 numMergedOcc 0
12 mol 238 unq 0 iso 0 dist 7.13194 8.83643 9.31417 9.87539 7.32982 16.0652 numMergedOcc 0
13 mol 238 unq 1 iso 0 dist 7.13194 4.55701 5.56719 9.87539 7.32982 11.468 numMergedOcc 0
14 mol 238 unq 2 iso 0 dist 7.80166 11.1397 9.31417 10.4401 7.32982 16.0652 numMergedOcc 0
15 mol 238 unq 3 iso 0 dist 7.80166 8.53461 5.56719 10.4401 7.32982 11.468 numMergedOcc 0
16 mol 252 unq 0 iso 0 dist 9.78185 11.3788 9.73021 13.7796 7.50201 7.37634 numMergedOcc 0
17 mol 253 unq 0 iso 0 dist 5.76077 8.19585 7.7993 5.37783 7.77998 5.75734 numMergedOcc 0
18 mol 253 unq 1 iso 0 dist 5.76077 6.8205 6.10761 5.37783 7.77998 10.1636 numMergedOcc 0
19 mol 253 unq 2 iso 0 dist 7.0247 14.4438 7.7993 14.5125 7.77998 5.75734 numMergedOcc 0
20 mol 253 unq 3 iso 0 dist 7.0247 10.5134 6.10761 14.5125 7.77998 10.1636 numMergedOcc 0
21 mol 259 unq 0 iso 0 dist 9.47382 12.8835 7.93997 15.3317 8.55558 13.6686 numMergedOcc 0
22 mol 271 unq 0 iso 0 dist 5.98336 8.87398 7.2671 6.29514 9.63775 6.71156 numMergedOcc 0
23 mol 272 unq 0 iso 0 dist 7.66615 14.8394 9.1118 6.43352 9.19033 16.9167 numMergedOcc 0
24 mol 282 unq 0 iso 0 dist 8.74201 8.46372 9.12049 5.59305 8.0241 8.9468 numMergedOcc 0
25 mol 282 unq 1 iso 0 dist 6.65024 3.7513 9.12049 6.6021 8.0241 8.9468 numMergedOcc 0
