0 mol 12 unq 0 iso 0 dist 9.75368 9.52857 10.9547 10.1802 14.7405 5.76024 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 9.75368 9.52857 10.9547 11.8349 13.8238 7.92714 numMergedOcc 0
2 mol 12 unq 2 iso 0 dist 9.75368 9.52857 10.9547 13.1322 18.7088 8.47217 numMergedOcc 0
3 mol 15 unq 0 iso 0 dist 6.82187 8.3794 9.75966 7.49229 5.89412 6.03257 numMergedOcc 0
4 mol 15 unq 1 iso 0 dist 6.60595 8.37378 10.1154 7.11548 6.42748 6.03257 numMergedOcc 0
5 mol 17 unq 0 iso 0 dist 8.58312 7.8304 5.67637 4.47542 9.78331 7.25951 numMergedOcc 0
6 mol 17 unq 1 iso 0 dist 8.58312 5.74567 4.03817 4.47542 9.78331 7.92012 numMergedOcc 0
7 mol 26 unq 0 iso 0 dist 6.12361 5.56687 7.23703 6.76331 6.46104 6.93197 numMergedOcc 0
8 mol 60 unq 0 iso 0 dist 7.7654 6.65867 5.32257 9.66932 11.6165 8.97364 numMergedOcc 0
9 mol 79 unq 0 iso 0 dist 8.0139 5.72627 7.23157 4.39227 11.1154 8.03296 numMergedOcc 0
10 mol 79 unq 1 iso 0 dist 8.0139 5.72627 7.23157 8.32896 8.77598 9.26979 numMergedOcc 0
11 mol 79 unq 2 iso 0 dist 8.0139 7.68741 12.5946 4.39227 11.1154 5.82754 numMergedOcc 0
12 mol 79 unq 3 iso 0 dist 8.0139 7.68741 12.5946 8.32896 8.77598 9.05679 numMergedOcc 0
13 mol 79 unq 4 iso 0 dist 8.0139 9.76351 9.69296 16.5814 15.1227 9.78384 numMergedOcc 0
14 mol 79 unq 5 iso 0 dist 8.0139 9.76351 9.69296 4.39227 11.1154 8.87742 numMergedOcc 0
15 mol 79 unq 6 iso 0 dist 8.0139 9.76351 9.69296 8.32896 8.77598 4.93468 numMergedOcc 0
16 mol 129 unq 0 iso 0 dist 8.59695 6.52844 4.55551 7.72162 9.36851 9.73158 numMergedOcc 0
17 mol 129 unq 1 iso 0 dist 8.59695 6.52844 4.55551 7.95267 4.97175 7.59327 numMergedOcc 0
18 mol 156 unq 0 iso 0 dist 8.50926 8.75305 10.8404 5.6621 9.00416 8.21184 numMergedOcc 0
19 mol 156 unq 1 iso 0 dist 8.50926 8.75305 10.8404 6.65278 11.5086 5.41575 numMergedOcc 0
20 mol 156 unq 2 iso 0 dist 8.50926 5.13522 5.18356 5.6621 9.00416 5.9976 numMergedOcc 0
21 mol 156 unq 3 iso 0 dist 8.50926 5.13522 5.18356 6.65278 11.5086 6.86566 numMergedOcc 0
22 mol 196 unq 0 iso 0 dist 9.84466 9.0515 9.09988 13.1553 16.6667 9.62455 numMergedOcc 0
23 mol 226 unq 0 iso 0 dist 9.30975 6.45143 7.92585 4.66376 8.80683 5.70795 numMergedOcc 0
24 mol 226 unq 1 iso 0 dist 9.14028 6.45143 7.554 4.66376 6.11704 5.70795 numMergedOcc 0
25 mol 273 unq 0 iso 0 dist 9.37841 9.65597 4.60101 4.73332 8.49177 7.16346 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 4.81916 9.35976 7.70529 10.7039 10.8214 8.20644 numMergedOcc 0
