0 mol 48 unq 0 iso 0 dist 6.04551 7.49794 13.0811 11.3175 7.78475 17.8213 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 6.01454 5.43913 9.12054 10.7098 6.99001 14.4644 numMergedOcc 0
2 mol 48 unq 2 iso 0 dist 6.01454 8.26877 13.688 10.7098 6.99001 17.9225 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.60363 7.02693 9.61302 15.52 9.53327 14.7637 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 9.07294 9.35049 3.75786 12.7741 8.70392 12.4466 numMergedOcc 0
5 mol 167 unq 0 iso 0 dist 9.82329 8.43955 9.16459 7.33075 9.69399 10.1387 numMergedOcc 0
6 mol 175 unq 0 iso 0 dist 6.21546 8.06007 7.97895 10.3139 9.27911 4.51777 numMergedOcc 0
7 mol 175 unq 1 iso 0 dist 6.21546 8.06007 7.97895 7.04147 8.57607 4.9606 numMergedOcc 0
8 mol 184 unq 0 iso 0 dist 9.45847 8.5544 15.8504 8.78943 5.0207 14.2301 numMergedOcc 0
9 mol 199 unq 0 iso 0 dist 9.88917 9.6189 9.65537 8.14324 9.43695 15.0077 numMergedOcc 0
10 mol 199 unq 1 iso 0 dist 9.56785 9.6189 11.7057 8.14324 8.32753 15.0077 numMergedOcc 0
11 mol 210 unq 0 iso 0 dist 6.41444 7.95917 5.30972 7.26107 8.87054 11.4954 numMergedOcc 0
12 mol 214 unq 0 iso 0 dist 7.25293 9.59498 4.99827 5.30923 7.43301 10.9626 numMergedOcc 0
13 mol 219 unq 0 iso 0 dist 4.67452 8.58891 5.15128 6.66401 9.30312 10.1516 numMergedOcc 0
14 mol 233 unq 0 iso 0 dist 7.21238 6.33954 9.32494 13.608 9.97082 18.3827 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 6.00654 7.24545 6.94281 5.86546 5.4347 10.0413 numMergedOcc 0
16 mol 279 unq 0 iso 0 dist 8.78203 9.98182 9.86569 14.4524 8.16582 18.0028 numMergedOcc 0
17 mol 285 unq 0 iso 0 dist 8.63954 6.07843 10.0892 5.52409 6.29045 10.4982 numMergedOcc 0
18 mol 285 unq 1 iso 0 dist 8.63954 9.66678 16.8309 5.52409 6.29045 15.1725 numMergedOcc 0
19 mol 285 unq 2 iso 0 dist 4.74716 6.07843 3.97296 6.15563 8.7964 10.9915 numMergedOcc 0
20 mol 285 unq 3 iso 0 dist 4.74716 6.07843 3.97296 5.52409 7.24072 10.4982 numMergedOcc 0
21 mol 285 unq 4 iso 0 dist 4.74716 9.66678 10.6606 6.15563 8.7964 13.427 numMergedOcc 0
22 mol 285 unq 5 iso 0 dist 4.74716 9.66678 10.6606 5.52409 7.24072 15.1725 numMergedOcc 0
