0 mol 25 unq 0 iso 0 dist 9.22151 9.95169 5.18617 11.6047 12.8446 8.53931 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 6.22122 9.95169 5.68041 11.6047 11.7303 8.53931 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 7.46207 9.56639 5.56139 7.35595 8.82012 5.84066 numMergedOcc 0
3 mol 72 unq 0 iso 0 dist 6.68311 9.26417 4.03844 13.1473 6.77912 6.53824 numMergedOcc 0
4 mol 72 unq 1 iso 0 dist 6.68311 9.26417 4.03844 16.7405 10.4226 7.67686 numMergedOcc 0
5 mol 72 unq 2 iso 0 dist 9.96602 9.26417 12.5604 13.1473 15.4914 6.53824 numMergedOcc 0
6 mol 72 unq 3 iso 0 dist 9.96602 9.26417 12.5604 16.7405 17.775 7.67686 numMergedOcc 0
7 mol 72 unq 4 iso 0 dist 6.7212 8.16985 7.47371 5.00053 7.321 9.14817 numMergedOcc 0
8 mol 72 unq 5 iso 0 dist 6.7212 7.81344 9.67587 5.00053 7.321 9.76686 numMergedOcc 0
9 mol 72 unq 6 iso 0 dist 6.7212 5.49421 7.07356 5.00053 7.321 9.437 numMergedOcc 0
10 mol 72 unq 7 iso 0 dist 9.08821 8.16985 8.59184 5.00053 12.0769 9.14817 numMergedOcc 0
11 mol 72 unq 8 iso 0 dist 9.08821 7.81344 10.04 5.00053 12.0769 9.76686 numMergedOcc 0
12 mol 72 unq 9 iso 0 dist 9.08821 5.49421 5.84044 5.00053 12.0769 9.437 numMergedOcc 0
13 mol 76 unq 0 iso 0 dist 6.62246 8.8326 5.31985 9.82998 6.21982 9.4866 numMergedOcc 0
14 mol 76 unq 1 iso 0 dist 6.62246 8.8326 5.31985 15.7506 12.0091 9.40363 numMergedOcc 0
15 mol 109 unq 0 iso 0 dist 8.84523 7.22752 6.35679 5.38332 5.87358 8.38791 numMergedOcc 0
16 mol 109 unq 1 iso 0 dist 8.84523 7.22752 6.35679 5.23865 11.6478 8.86037 numMergedOcc 0
17 mol 109 unq 2 iso 0 dist 9.45397 7.22752 4.94189 5.38332 9.20981 8.38791 numMergedOcc 0
18 mol 109 unq 3 iso 0 dist 9.45397 7.22752 4.94189 5.23865 12.8339 8.86037 numMergedOcc 0
19 mol 119 unq 0 iso 0 dist 8.88255 6.88175 6.9194 10.06 9.63176 6.55202 numMergedOcc 0
20 mol 134 unq 0 iso 0 dist 5.22024 7.49352 4.63567 10.8174 9.30812 6.57379 numMergedOcc 0
21 mol 134 unq 1 iso 0 dist 6.54987 6.41759 5.91192 6.63186 7.77454 5.52149 numMergedOcc 0
22 mol 144 unq 0 iso 0 dist 9.81485 6.03283 8.65006 7.47518 16.376 9.09684 numMergedOcc 0
23 mol 155 unq 0 iso 0 dist 5.68636 8.14405 4.91785 7.441 9.38946 7.29911 numMergedOcc 0
24 mol 155 unq 1 iso 0 dist 5.68636 8.14405 4.91785 6.79302 7.36102 5.36254 numMergedOcc 0
25 mol 217 unq 0 iso 0 dist 6.74267 4.92885 4.64118 7.79829 10.0092 9.59084 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 7.61478 9.40158 5.79187 12.3374 13.9201 9.38131 numMergedOcc 0
27 mol 238 unq 1 iso 0 dist 7.61478 9.40158 5.79187 5.92575 8.96531 6.85253 numMergedOcc 0
28 mol 238 unq 2 iso 0 dist 7.61478 9.40158 5.79187 15.6966 10.5309 9.08687 numMergedOcc 0
29 mol 238 unq 3 iso 0 dist 4.87108 5.41453 6.82305 11.6924 12.1937 7.39547 numMergedOcc 0
30 mol 238 unq 4 iso 0 dist 4.87108 5.41453 6.82305 5.61491 7.49471 7.24334 numMergedOcc 0
31 mol 238 unq 5 iso 0 dist 7.64276 5.41453 5.71717 11.6924 7.67322 7.39547 numMergedOcc 0
32 mol 238 unq 6 iso 0 dist 7.64276 5.41453 5.71717 5.61491 7.19008 7.24334 numMergedOcc 0
33 mol 259 unq 0 iso 0 dist 8.57619 9.2885 4.04513 5.4536 8.37865 8.84648 numMergedOcc 0
