0 mol 11 unq 0 iso 0 dist 5.34687 10.2968 6.83186 14.5986 9.26728 9.04534 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 5.26736 10.0741 6.83186 14.7097 9.46202 9.07476 numMergedOcc 0
2 mol 98 unq 0 iso 0 dist 8.43668 11.7522 6.5816 5.08451 4.48773 9.68556 numMergedOcc 0
3 mol 98 unq 1 iso 0 dist 8.43668 11.7522 6.5816 9.64349 3.78499 8.73928 numMergedOcc 0
4 mol 98 unq 2 iso 0 dist 4.62343 5.10714 6.5816 8.3399 4.48773 9.68556 numMergedOcc 0
5 mol 98 unq 3 iso 0 dist 4.62343 5.10714 6.5816 8.23389 3.78499 8.73928 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 6.49185 7.5374 7.02358 10.1082 5.96967 9.86767 numMergedOcc 0
7 mol 151 unq 0 iso 0 dist 7.79925 11.5622 9.37533 16.2985 9.37572 9.98086 numMergedOcc 0
8 mol 151 unq 1 iso 0 dist 7.79925 11.5622 9.37533 14.1475 8.61721 8.89982 numMergedOcc 0
9 mol 151 unq 2 iso 0 dist 7.79925 11.5622 9.37533 7.70406 3.96406 6.12972 numMergedOcc 0
10 mol 169 unq 0 iso 0 dist 7.95377 6.57889 5.10589 6.44618 4.24401 7.50458 numMergedOcc 0
11 mol 169 unq 1 iso 0 dist 7.95377 5.83343 4.63336 6.44618 4.24401 5.79554 numMergedOcc 0
12 mol 169 unq 2 iso 0 dist 7.95377 4.39759 6.10715 6.44618 4.24401 4.22003 numMergedOcc 0
13 mol 169 unq 3 iso 0 dist 6.7265 7.73114 6.96715 10.0951 5.74428 9.58901 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 5.65561 6.02214 4.87942 8.84433 3.42324 7.69952 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 6.90148 6.02214 7.25595 8.84433 8.26669 7.69952 numMergedOcc 0
16 mol 186 unq 2 iso 0 dist 6.30614 6.71348 7.25595 12.5251 8.26669 7.69952 numMergedOcc 0
17 mol 266 unq 0 iso 0 dist 6.56474 9.69447 6.96692 13.3756 7.2339 9.35293 numMergedOcc 0
18 mol 266 unq 1 iso 0 dist 6.56474 9.69447 6.96692 9.99482 3.87565 7.93375 numMergedOcc 0
19 mol 266 unq 2 iso 0 dist 6.81489 9.69447 8.25286 13.3756 12.15 9.35293 numMergedOcc 0
20 mol 266 unq 3 iso 0 dist 6.81489 9.69447 8.25286 9.99482 9.25882 7.93375 numMergedOcc 0
21 mol 266 unq 4 iso 0 dist 8.79185 9.69447 9.9965 13.3756 14.8334 9.35293 numMergedOcc 0
22 mol 266 unq 5 iso 0 dist 8.79185 9.69447 9.9965 9.99482 12.1357 7.93375 numMergedOcc 0
23 mol 287 unq 0 iso 0 dist 8.98138 10.0104 4.68668 13.9159 9.51119 7.84189 numMergedOcc 0
24 mol 288 unq 0 iso 0 dist 8.98138 10.0104 4.68668 13.9159 9.51119 7.84189 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 8.98138 10.0104 4.68668 13.9159 9.51119 7.84189 numMergedOcc 0
