0 mol 122 unq 0 iso 0 dist 9.21665 8.68384 13.4677 8.58081 6.97281 8.13856 numMergedOcc 0
1 mol 125 unq 0 iso 0 dist 6.6081 8.75402 4.77979 9.93888 6.06801 6.26399 numMergedOcc 0
2 mol 134 unq 0 iso 0 dist 7.94564 6.00896 6.01484 6.41759 4.77133 7.45747 numMergedOcc 0
3 mol 134 unq 1 iso 0 dist 9.21999 6.00896 10.6104 6.41759 4.56331 7.45747 numMergedOcc 0
4 mol 142 unq 0 iso 0 dist 9.5355 7.21779 7.46089 5.90339 9.23267 4.65943 numMergedOcc 0
5 mol 184 unq 0 iso 0 dist 5.13722 8.49577 8.78766 9.07247 10.6375 13.4486 numMergedOcc 0
6 mol 193 unq 0 iso 0 dist 9.16852 7.71716 3.53549 8.28942 9.98298 7.03555 numMergedOcc 0
7 mol 205 unq 0 iso 0 dist 8.21112 6.02053 8.82544 7.18098 11.3947 3.73699 numMergedOcc 0
8 mol 205 unq 1 iso 0 dist 9.90674 8.63185 4.98206 6.92823 6.10129 6.22981 numMergedOcc 0
9 mol 205 unq 2 iso 0 dist 9.90674 7.25362 8.94296 6.92823 6.10129 4.7106 numMergedOcc 0
10 mol 209 unq 0 iso 0 dist 7.757 8.20431 5.86856 9.73136 5.58598 5.3027 numMergedOcc 0
11 mol 209 unq 1 iso 0 dist 7.757 8.8886 8.13817 9.73136 5.58598 5.01087 numMergedOcc 0
12 mol 222 unq 0 iso 0 dist 9.5045 5.17916 6.77642 7.61739 11.9017 6.4817 numMergedOcc 0
13 mol 222 unq 1 iso 0 dist 9.5045 5.17916 6.77642 9.59191 9.63121 8.05936 numMergedOcc 0
14 mol 224 unq 0 iso 0 dist 9.92947 5.07376 12.9085 5.88041 15.6142 4.67513 numMergedOcc 0
15 mol 224 unq 1 iso 0 dist 7.46044 5.07376 4.49347 5.88041 3.56689 4.67513 numMergedOcc 0
16 mol 224 unq 2 iso 0 dist 8.68767 8.18749 4.42976 5.31916 7.57013 5.81697 numMergedOcc 0
17 mol 235 unq 0 iso 0 dist 7.52696 7.30003 4.81997 6.50932 5.39025 3.89748 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 8.01565 7.10828 5.94643 6.0567 3.80345 7.26668 numMergedOcc 0
19 mol 239 unq 1 iso 0 dist 8.33254 8.92121 11.8831 8.03092 14.4546 11.1207 numMergedOcc 0
20 mol 260 unq 0 iso 0 dist 9.05149 8.13605 11.3568 9.68232 6.37501 7.02274 numMergedOcc 0
21 mol 260 unq 1 iso 0 dist 9.05149 8.13605 11.3568 8.29663 7.50166 4.58993 numMergedOcc 0
22 mol 261 unq 0 iso 0 dist 8.64393 8.25759 7.45398 9.4157 5.01937 6.97209 numMergedOcc 0
23 mol 261 unq 1 iso 0 dist 8.64393 6.99444 7.70154 9.4157 5.01937 4.64981 numMergedOcc 0
24 mol 267 unq 0 iso 0 dist 5.32643 6.79491 9.17078 4.42902 4.74052 6.15683 numMergedOcc 0
25 mol 270 unq 0 iso 0 dist 7.65449 6.32507 5.64329 8.75041 13.3415 8.39953 numMergedOcc 0
26 mol 273 unq 0 iso 0 dist 9.36052 7.84151 10.402 8.28809 6.08276 8.8839 numMergedOcc 0
27 mol 273 unq 1 iso 0 dist 9.36052 7.85797 5.78379 8.28809 6.08276 7.90253 numMergedOcc 0
28 mol 279 unq 0 iso 0 dist 8.87355 8.52827 10.2078 9.44618 5.10922 13.4439 numMergedOcc 0
29 mol 280 unq 0 iso 0 dist 9.047 6.38295 14.0927 6.16546 12.331 4.06908 numMergedOcc 0
30 mol 280 unq 1 iso 0 dist 9.9227 6.38295 11.4101 6.16546 7.42656 4.06908 numMergedOcc 0
31 mol 283 unq 0 iso 0 dist 6.15136 6.53354 6.84734 8.39635 8.90736 7.87842 numMergedOcc 0
32 mol 283 unq 1 iso 0 dist 6.15136 6.93798 4.67572 8.39635 8.90736 5.55396 numMergedOcc 0
