0 mol 0 unq 0 iso 0 dist 7.30381 6.58151 6.64713 7.37981 5.24778 6.26831 numMergedOcc 0
1 mol 13 unq 0 iso 0 dist 9.57675 6.67016 7.98679 7.97656 4.56335 5.78148 numMergedOcc 0
2 mol 13 unq 1 iso 0 dist 9.57675 6.67016 7.98679 11.8686 8.87621 6.26071 numMergedOcc 0
3 mol 13 unq 2 iso 0 dist 9.57675 6.67016 7.98679 14.9969 12.9999 8.43325 numMergedOcc 0
4 mol 13 unq 3 iso 0 dist 8.84159 14.442 7.98679 13.0816 4.56335 5.78148 numMergedOcc 0
5 mol 13 unq 4 iso 0 dist 8.84159 14.442 7.98679 15.0208 8.87621 6.26071 numMergedOcc 0
6 mol 13 unq 5 iso 0 dist 8.84159 14.442 7.98679 17.0066 12.9999 8.43325 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 7.88172 9.94237 6.62229 13.4086 5.85698 7.27383 numMergedOcc 0
8 mol 60 unq 0 iso 0 dist 9.34193 11.7103 4.65127 17.2674 11.2415 9.96399 numMergedOcc 0
9 mol 60 unq 1 iso 0 dist 9.34193 11.7103 4.65127 10.5768 5.94827 7.55695 numMergedOcc 0
10 mol 60 unq 2 iso 0 dist 9.34193 11.7103 4.65127 6.27749 5.32257 8.82176 numMergedOcc 0
11 mol 73 unq 0 iso 0 dist 6.91141 4.73318 6.48232 10.1845 5.11416 7.04044 numMergedOcc 0
12 mol 73 unq 1 iso 0 dist 6.91141 4.73318 6.48232 10.8928 6.56633 8.73253 numMergedOcc 0
13 mol 73 unq 2 iso 0 dist 9.53327 6.28525 7.62738 9.02288 14.6243 8.03303 numMergedOcc 0
14 mol 73 unq 3 iso 0 dist 9.71873 5.9876 7.62738 12.6321 14.6243 8.03303 numMergedOcc 0
15 mol 85 unq 0 iso 0 dist 5.79841 13.3069 8.70863 12.3148 11.165 8.00777 numMergedOcc 0
16 mol 85 unq 1 iso 0 dist 5.79841 13.3069 8.70863 10.7029 9.29301 7.1589 numMergedOcc 0
17 mol 98 unq 0 iso 0 dist 4.96613 6.4628 6.62972 6.67936 4.67519 5.88354 numMergedOcc 0
18 mol 98 unq 1 iso 0 dist 4.96613 6.4628 6.62972 10.4233 6.6076 7.89665 numMergedOcc 0
19 mol 98 unq 2 iso 0 dist 4.96613 6.4628 6.62972 10.7879 10.6513 5.39354 numMergedOcc 0
20 mol 98 unq 3 iso 0 dist 4.96613 6.4628 6.62972 8.25817 10.4027 5.74854 numMergedOcc 0
21 mol 98 unq 4 iso 0 dist 4.96613 6.4628 6.62972 14.7214 12.3568 8.76566 numMergedOcc 0
22 mol 98 unq 5 iso 0 dist 4.96613 6.4628 6.62972 15.072 14.5457 8.8368 numMergedOcc 0
23 mol 100 unq 0 iso 0 dist 9.95103 6.04919 9.5669 11.5472 9.75737 7.12017 numMergedOcc 0
24 mol 109 unq 0 iso 0 dist 9.10677 5.70461 6.76575 6.31633 7.20706 8.67766 numMergedOcc 0
25 mol 109 unq 1 iso 0 dist 9.10677 5.70461 6.76575 7.21115 5.35728 8.0831 numMergedOcc 0
26 mol 112 unq 0 iso 0 dist 9.69961 4.26804 9.77017 6.85381 5.39346 8.729 numMergedOcc 0
27 mol 114 unq 0 iso 0 dist 7.78223 10.8586 9.35942 16.692 12.7083 6.34525 numMergedOcc 0
28 mol 114 unq 1 iso 0 dist 7.78223 11.0397 7.42482 13.5929 7.12268 9.7918 numMergedOcc 0
29 mol 119 unq 0 iso 0 dist 6.13508 7.09096 9.9151 9.93703 7.45148 7.99623 numMergedOcc 0
30 mol 120 unq 0 iso 0 dist 9.37051 9.0525 6.03352 16.7481 8.2619 8.93905 numMergedOcc 0
31 mol 129 unq 0 iso 0 dist 9.86237 10.2048 9.94578 11.5151 4.55551 8.03372 numMergedOcc 0
32 mol 130 unq 0 iso 0 dist 5.96506 9.65804 9.13191 11.8602 8.01932 9.28592 numMergedOcc 0
33 mol 162 unq 0 iso 0 dist 8.62413 5.16577 7.14263 9.82249 4.20425 6.20182 numMergedOcc 0
34 mol 175 unq 0 iso 0 dist 6.53696 10.9098 5.60528 11.4946 6.77832 7.35824 numMergedOcc 0
35 mol 175 unq 1 iso 0 dist 6.53696 5.31207 5.5995 11.4946 6.77832 9.17364 numMergedOcc 0
36 mol 188 unq 0 iso 0 dist 9.24734 7.16694 5.73306 14.0931 6.43967 8.47347 numMergedOcc 0
37 mol 220 unq 0 iso 0 dist 9.05637 8.06536 5.37796 13.1834 7.11498 5.45036 numMergedOcc 0
38 mol 227 unq 0 iso 0 dist 7.17024 11.481 7.95359 11.3667 6.67321 5.87815 numMergedOcc 0
39 mol 248 unq 0 iso 0 dist 8.53033 12.2076 7.97135 12.4697 4.30004 6.77954 numMergedOcc 0
40 mol 253 unq 0 iso 0 dist 9.6479 12.0513 8.15091 10.7862 5.78064 7.77998 numMergedOcc 0
41 mol 274 unq 0 iso 0 dist 9.02661 16.9837 8.2997 12.0331 5.29529 9.56685 numMergedOcc 0
42 mol 277 unq 0 iso 0 dist 5.92532 8.7465 7.85414 10.9325 6.28695 6.57903 numMergedOcc 0
43 mol 277 unq 1 iso 0 dist 5.92532 8.7465 7.85414 9.76735 4.39413 9.65707 numMergedOcc 0
44 mol 277 unq 2 iso 0 dist 9.55366 7.23731 8.81717 11.9435 4.50065 9.3936 numMergedOcc 0
