0 mol 9 unq 0 iso 0 dist 6.20227 5.06967 5.55437 11.5992 7.28672 8.076 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 6.6347 8.11848 5.38458 11.0495 5.60208 6.32226 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 7.62728 10.1989 8.58543 16.0164 15.4757 7.62738 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 8.40501 12.4203 9.01011 13.4884 9.98219 8.29345 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 9.82156 13.1109 9.01011 18.5812 9.98219 8.29345 numMergedOcc 0
5 mol 92 unq 2 iso 0 dist 9.93806 10.439 7.39754 11.2646 5.8102 8.29345 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 9.56707 14.7644 9.92553 18.3304 10.9279 6.76575 numMergedOcc 0
7 mol 109 unq 1 iso 0 dist 9.06397 12.8592 9.92553 17.4067 10.9279 6.76575 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 8.81779 8.58511 8.03035 7.84768 6.96805 8.8562 numMergedOcc 0
9 mol 119 unq 1 iso 0 dist 8.81779 8.58511 8.03035 15.5695 13.3975 7.91683 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 8.34503 10.6067 7.76594 9.66687 5.67023 5.44303 numMergedOcc 0
11 mol 131 unq 1 iso 0 dist 8.34503 10.6067 7.76594 13.1331 10.9757 8.50562 numMergedOcc 0
12 mol 131 unq 2 iso 0 dist 5.70499 12.4872 7.76594 9.68242 5.67023 5.44303 numMergedOcc 0
13 mol 131 unq 3 iso 0 dist 5.70499 12.4872 7.76594 14.1386 10.9757 8.50562 numMergedOcc 0
14 mol 163 unq 0 iso 0 dist 7.27002 5.57459 7.3546 9.54144 15.9955 9.79069 numMergedOcc 0
15 mol 163 unq 1 iso 0 dist 7.27002 5.57459 7.3546 7.49813 5.87447 9.27496 numMergedOcc 0
16 mol 171 unq 0 iso 0 dist 7.75632 5.76368 7.82546 6.73995 6.29877 7.32555 numMergedOcc 0
17 mol 194 unq 0 iso 0 dist 7.39369 6.2135 5.52678 10.4112 5.92931 6.37788 numMergedOcc 0
18 mol 194 unq 1 iso 0 dist 7.39369 13.7 9.81666 10.4112 5.92931 8.7028 numMergedOcc 0
19 mol 225 unq 0 iso 0 dist 9.33639 9.7379 6.53728 12.7429 14.3973 9.23935 numMergedOcc 0
20 mol 225 unq 1 iso 0 dist 9.33639 9.7379 6.53728 14.2785 13.923 7.77552 numMergedOcc 0
21 mol 225 unq 2 iso 0 dist 9.18343 15.612 6.53728 11.2247 6.59663 8.20162 numMergedOcc 0
22 mol 237 unq 0 iso 0 dist 8.32964 4.83024 7.63812 7.3216 5.90415 5.6703 numMergedOcc 0
23 mol 237 unq 1 iso 0 dist 8.32964 4.83024 7.63812 12.4829 9.2471 8.72819 numMergedOcc 0
24 mol 284 unq 0 iso 0 dist 5.49079 4.98629 7.97588 13.9966 16.5329 9.63007 numMergedOcc 0
