0 mol 15 unq 0 iso 0 dist 9.51568 6.19131 6.23015 6.50647 5.20798 6.03257 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 8.53931 6.06874 6.53269 10.7875 9.62058 6.25843 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 8.53931 6.06874 6.53269 6.63839 5.38592 8.88938 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 5.84066 4.98603 6.07276 11.8125 10.1622 6.93197 numMergedOcc 0
4 mol 26 unq 1 iso 0 dist 9.06516 11.553 6.81793 5.497 4.76998 6.56527 numMergedOcc 0
5 mol 26 unq 2 iso 0 dist 6.79475 7.26595 9.96912 6.15893 6.64374 7.35861 numMergedOcc 0
6 mol 26 unq 3 iso 0 dist 9.96121 10.8434 6.81793 12.2621 4.76998 6.56527 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 7.95451 12.9103 7.98985 19.0054 12.5617 6.74766 numMergedOcc 0
8 mol 79 unq 0 iso 0 dist 6.52939 6.49291 7.43127 9.63599 9.51372 9.78384 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 4.44979 10.2677 9.25444 6.0129 3.92737 7.36769 numMergedOcc 0
10 mol 98 unq 1 iso 0 dist 4.44979 5.71029 8.46823 6.0129 3.92737 6.88901 numMergedOcc 0
11 mol 98 unq 2 iso 0 dist 6.61111 10.2677 9.84703 6.0129 3.94967 7.36769 numMergedOcc 0
12 mol 98 unq 3 iso 0 dist 6.61111 5.71029 4.62494 6.0129 3.94967 6.88901 numMergedOcc 0
13 mol 112 unq 0 iso 0 dist 8.91262 10.8329 8.72725 9.70559 8.72143 7.80873 numMergedOcc 0
14 mol 112 unq 1 iso 0 dist 6.12922 10.8329 6.11407 9.70559 5.08111 7.80873 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 8.55349 11.5342 8.83732 9.50664 6.24625 8.95662 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 9.09234 11.5017 8.12266 16.1857 14.2282 7.22883 numMergedOcc 0
17 mol 181 unq 1 iso 0 dist 8.92098 11.5017 9.43306 16.1857 10.273 7.22883 numMergedOcc 0
18 mol 194 unq 0 iso 0 dist 7.10155 4.26755 9.00322 8.52969 7.41775 6.38324 numMergedOcc 0
19 mol 274 unq 0 iso 0 dist 6.66172 12.625 9.65868 14.1967 10.7442 7.75216 numMergedOcc 0
20 mol 274 unq 1 iso 0 dist 6.66172 4.60275 8.60027 11.4246 13.3632 6.88827 numMergedOcc 0
21 mol 274 unq 2 iso 0 dist 6.66172 4.60275 8.60027 9.20749 5.39432 9.16942 numMergedOcc 0
