0 mol 26 unq 0 iso 0 dist 8.99751 9.90986 5.29055 14.3129 13.6548 9.12845 6.77783 6.15893 9.06516 14.1424 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.99751 9.90986 5.29055 14.3129 13.6548 9.12845 11.7823 14.2674 9.96121 6.10146 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 9.44507 9.90986 4.76998 14.3129 10.3756 9.12845 6.77783 5.497 9.06516 14.1424 numMergedOcc 0
3 mol 26 unq 3 iso 0 dist 9.44507 9.90986 4.76998 14.3129 10.3756 9.12845 11.7823 12.2621 9.96121 6.10146 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 9.4486 7.32064 8.39195 7.17843 11.4999 6.85523 10.1263 10.5623 5.47706 4.92509 numMergedOcc 0
5 mol 78 unq 1 iso 0 dist 9.4486 7.32064 8.39195 13.1649 15.5721 8.65848 10.1263 10.5623 5.47706 5.22036 numMergedOcc 0
6 mol 78 unq 2 iso 0 dist 9.4486 5.85007 7.71963 7.17843 11.4999 5.77326 10.1263 10.5623 8.07568 4.92509 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 9.25249 8.3505 17.4008 4.75138 13.8815 5.10496 12.8333 21.7536 6.61111 8.70415 numMergedOcc 0
8 mol 98 unq 1 iso 0 dist 9.25249 8.3505 17.4008 10.4417 17.8091 5.92242 12.8333 21.7536 6.61111 9.74284 numMergedOcc 0
9 mol 98 unq 2 iso 0 dist 9.25249 8.3505 17.4008 11.3628 19.9118 5.2571 12.8333 21.7536 6.61111 10.0962 numMergedOcc 0
10 mol 98 unq 3 iso 0 dist 9.25249 8.3505 17.4008 13.9599 22.4773 8.7497 12.8333 21.7536 6.61111 11.2452 numMergedOcc 0
11 mol 98 unq 4 iso 0 dist 5.94696 5.08983 3.92737 10.1978 12.5931 9.64383 9.47873 6.0129 4.44979 12.0058 numMergedOcc 0
12 mol 98 unq 5 iso 0 dist 5.94696 5.08983 3.92737 7.1452 4.47349 7.54889 9.47873 6.0129 4.44979 10.0962 numMergedOcc 0
13 mol 98 unq 6 iso 0 dist 5.94696 5.08983 3.92737 4.96747 5.65185 7.78931 9.47873 6.0129 4.44979 11.2452 numMergedOcc 0
14 mol 112 unq 0 iso 0 dist 6.09626 4.77996 5.08111 4.34071 9.28592 5.56994 6.40435 9.70559 6.12922 6.35364 numMergedOcc 0
15 mol 146 unq 0 iso 0 dist 7.13378 6.93154 8.9669 5.44003 12.2161 9.04757 10.2064 13.9866 5.41078 9.18212 numMergedOcc 0
16 mol 167 unq 0 iso 0 dist 9.14629 6.48993 5.95858 6.64464 11.6896 6.84752 4.0737 7.80054 7.30954 7.69326 numMergedOcc 0
17 mol 167 unq 1 iso 0 dist 9.14629 6.48993 5.95858 5.70785 12.8466 7.86563 4.0737 7.80054 7.30954 9.46955 numMergedOcc 0
18 mol 167 unq 2 iso 0 dist 9.14629 6.48993 5.95858 7.91498 9.67741 7.02548 4.0737 7.80054 7.30954 6.36909 numMergedOcc 0
19 mol 168 unq 0 iso 0 dist 8.90876 7.30338 4.02702 12.1014 7.44629 6.02086 6.39941 7.60254 7.06851 8.67522 numMergedOcc 0
20 mol 219 unq 0 iso 0 dist 7.13099 6.52136 5.75906 5.0241 7.59632 4.33238 6.16486 11.4406 7.30481 4.74167 numMergedOcc 0
21 mol 219 unq 1 iso 0 dist 7.13099 6.52136 5.75906 4.36122 10.3776 7.83604 6.16486 11.4406 7.30481 4.9853 numMergedOcc 0
22 mol 274 unq 0 iso 0 dist 9.11072 4.97796 13.3632 4.56913 12.2077 6.4611 5.95459 11.4246 6.66172 5.31116 numMergedOcc 0
23 mol 274 unq 1 iso 0 dist 6.83113 4.97796 5.39432 4.56913 10.5387 6.4611 5.95459 9.20749 6.66172 5.31116 numMergedOcc 0
24 mol 274 unq 2 iso 0 dist 9.44134 4.97796 10.7442 4.56913 13.9123 6.4611 5.95459 14.1967 6.66172 5.31116 numMergedOcc 0
25 mol 292 unq 0 iso 0 dist 6.60049 7.78796 3.92782 6.94727 9.88863 9.74118 7.69175 5.7131 6.1905 5.98906 numMergedOcc 0
