0 mol 20 unq 0 iso 0 dist 9.37411 6.68339 8.38129 9.00405 7.47395 4.8515 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.27488 5.82545 5.92521 5.01774 8.28202 7.02503 numMergedOcc 0
2 mol 33 unq 0 iso 0 dist 9.6595 9.09375 8.28474 6.2086 4.78873 5.27955 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 9.66932 5.17275 4.98509 9.39237 6.38866 4.96488 numMergedOcc 0
4 mol 34 unq 1 iso 0 dist 9.66932 6.29323 9.76633 9.39237 6.38866 10.8732 numMergedOcc 0
5 mol 72 unq 0 iso 0 dist 9.85325 10.5452 9.58357 10.2533 6.79423 8.70071 numMergedOcc 0
6 mol 111 unq 0 iso 0 dist 9.83758 14.294 7.36025 11.2375 4.91212 4.21801 numMergedOcc 0
7 mol 111 unq 1 iso 0 dist 9.83758 14.294 7.36025 6.87591 9.34782 10.0002 numMergedOcc 0
8 mol 239 unq 0 iso 0 dist 9.0495 10.1773 6.8123 10.7268 6.09626 10.3384 numMergedOcc 0
9 mol 254 unq 0 iso 0 dist 8.26189 5.08307 5.39865 12.399 7.85841 9.02593 numMergedOcc 0
10 mol 254 unq 1 iso 0 dist 7.57834 9.08626 5.0346 12.6878 9.20109 9.02593 numMergedOcc 0
11 mol 254 unq 2 iso 0 dist 5.75348 5.08307 5.0346 12.399 9.20109 9.02593 numMergedOcc 0
12 mol 260 unq 0 iso 0 dist 4.54064 4.96171 8.43724 8.11438 7.04263 13.0517 numMergedOcc 0
13 mol 260 unq 1 iso 0 dist 4.54064 4.96171 8.43724 3.43932 6.48099 5.75061 numMergedOcc 0
14 mol 260 unq 2 iso 0 dist 5.33881 4.11741 7.30584 12.1108 8.62655 13.4352 numMergedOcc 0
15 mol 268 unq 0 iso 0 dist 8.24792 5.11731 7.04565 7.87564 9.52476 11.3819 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 8.27196 8.1743 7.81225 4.69872 6.24487 4.01495 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 8.27196 8.1743 7.81225 4.69872 6.24487 4.01495 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 8.27196 8.1743 7.81225 4.69872 6.24487 4.01495 numMergedOcc 0
