0 mol 7 unq 0 iso 0 dist 5.51421 7.81271 5.13353 6.769 6.8464 9.15183 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.81271 5.51421 5.13353 6.769 9.15183 6.8464 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 9.00229 8.05508 11.2395 12.9552 9.75265 18.0959 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 5.47319 9.8809 8.99811 4.2124 7.25721 10.6812 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 9.65047 8.69069 15.3836 16.8321 9.64673 23.6213 numMergedOcc 0
5 mol 112 unq 0 iso 0 dist 7.15985 7.53905 10.838 12.3624 9.90769 19.1112 numMergedOcc 0
6 mol 129 unq 0 iso 0 dist 9.28278 8.78082 10.5871 4.74644 8.00624 8.42289 numMergedOcc 0
7 mol 129 unq 1 iso 0 dist 8.78082 9.28278 10.5871 4.74644 8.42289 8.00624 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 9.50322 5.82404 8.18495 15.9933 9.1146 15.6213 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 9.92932 9.60411 5.49782 5.73962 9.16358 6.48328 numMergedOcc 0
10 mol 134 unq 1 iso 0 dist 9.60411 9.92932 5.49782 5.73962 6.48328 9.16358 numMergedOcc 0
11 mol 134 unq 2 iso 0 dist 9.55556 9.60369 5.62899 10.971 9.16358 14.1509 numMergedOcc 0
12 mol 197 unq 0 iso 0 dist 8.3337 5.41292 6.75702 14.6381 8.67786 15.0736 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 9.36079 8.46319 7.73294 15.9979 8.11407 11.7131 numMergedOcc 0
14 mol 206 unq 1 iso 0 dist 7.42904 9.11298 7.73294 13.397 8.11407 11.7131 numMergedOcc 0
15 mol 224 unq 0 iso 0 dist 8.46129 8.39002 5.0744 6.32111 8.80858 10.8126 numMergedOcc 0
16 mol 224 unq 1 iso 0 dist 8.46129 9.2053 6.91102 6.32111 8.80858 13.3427 numMergedOcc 0
17 mol 229 unq 0 iso 0 dist 7.10634 8.6537 10.6558 3.99138 9.40032 12.0016 numMergedOcc 0
18 mol 229 unq 1 iso 0 dist 7.10634 8.75374 6.87246 3.99138 9.40032 12.1944 numMergedOcc 0
19 mol 229 unq 2 iso 0 dist 7.10634 5.57702 7.08329 3.99138 9.40032 9.49008 numMergedOcc 0
20 mol 236 unq 0 iso 0 dist 9.89665 9.05929 14.7998 4.93347 6.61371 12.4813 numMergedOcc 0
21 mol 236 unq 1 iso 0 dist 6.11137 7.89744 6.59448 4.24722 5.90804 10.7277 numMergedOcc 0
22 mol 261 unq 0 iso 0 dist 9.73983 8.65236 7.00201 5.96176 7.00833 10.0402 numMergedOcc 0
23 mol 274 unq 0 iso 0 dist 8.49076 9.09967 12.8986 5.02003 8.88221 13.1113 numMergedOcc 0
24 mol 274 unq 1 iso 0 dist 8.49076 9.09967 12.8986 12.6116 9.65027 20.6221 numMergedOcc 0
25 mol 293 unq 0 iso 0 dist 6.27435 9.55282 10.9721 6.74585 5.44043 11.5814 numMergedOcc 0
26 mol 293 unq 1 iso 0 dist 6.27435 9.55282 10.9721 4.13058 9.25564 13.2949 numMergedOcc 0
