0 mol 20 unq 0 iso 0 dist 6.29578 5.86076 6.29237 8.72513 9.24286 3.49913 numMergedOcc 0
1 mol 20 unq 0 iso 1 dist 6.29578 8.72513 9.24286 5.86076 6.29237 3.49913 numMergedOcc 0
2 mol 81 unq 0 iso 0 dist 9.78763 14.5186 7.1229 8.57407 9.36388 10.1134 numMergedOcc 0
3 mol 81 unq 0 iso 1 dist 9.78763 8.57407 9.36388 14.5186 7.1229 10.1134 numMergedOcc 0
4 mol 107 unq 0 iso 0 dist 7.06322 4.05182 6.71858 4.11617 9.37159 7.4799 numMergedOcc 0
5 mol 107 unq 0 iso 1 dist 7.06322 4.11617 9.37159 4.05182 6.71858 7.4799 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 5.6738 7.16792 6.41507 7.6316 6.03035 5.05513 numMergedOcc 0
7 mol 113 unq 0 iso 1 dist 5.6738 7.6316 6.03035 7.16792 6.41507 5.05513 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 7.77458 3.64555 5.35285 4.78701 6.71328 5.83782 numMergedOcc 0
9 mol 134 unq 0 iso 1 dist 7.77458 4.78701 6.71328 3.64555 5.35285 5.83782 numMergedOcc 0
10 mol 135 unq 0 iso 0 dist 9.53367 8.47361 5.27399 9.12064 5.72277 3.61409 numMergedOcc 0
11 mol 135 unq 0 iso 1 dist 9.53367 9.12064 5.72277 8.47361 5.27399 3.61409 numMergedOcc 0
12 mol 135 unq 1 iso 0 dist 9.53367 8.47361 5.27399 11.3276 9.79769 6.09264 numMergedOcc 0
13 mol 135 unq 1 iso 1 dist 9.53367 11.3276 9.79769 8.47361 5.27399 6.09264 numMergedOcc 0
14 mol 135 unq 1 iso 0 dist 9.53367 9.12064 5.72277 11.3276 9.79769 9.58817 numMergedOcc 0
15 mol 135 unq 1 iso 1 dist 9.53367 11.3276 9.79769 9.12064 5.72277 9.58817 numMergedOcc 0
16 mol 219 unq 0 iso 0 dist 9.72263 9.45086 6.44817 9.24289 9.36547 14.0465 numMergedOcc 0
17 mol 219 unq 0 iso 1 dist 9.72263 9.24289 9.36547 9.45086 6.44817 14.0465 numMergedOcc 0
18 mol 219 unq 1 iso 0 dist 9.65487 8.10855 6.44817 11.1295 9.36547 14.0465 numMergedOcc 0
19 mol 219 unq 1 iso 1 dist 9.65487 11.1295 9.36547 8.10855 6.44817 14.0465 numMergedOcc 0
20 mol 229 unq 0 iso 0 dist 5.82844 7.5737 8.34954 4.39666 9.27328 6.12355 numMergedOcc 0
21 mol 229 unq 0 iso 1 dist 5.82844 4.39666 9.27328 7.5737 8.34954 6.12355 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 7.64453 14.1553 9.62446 4.60276 9.99681 13.523 numMergedOcc 0
23 mol 287 unq 0 iso 1 dist 7.64453 4.60276 9.99681 14.1553 9.62446 13.523 numMergedOcc 0
24 mol 288 unq 0 iso 0 dist 7.64453 14.1553 9.62446 4.60276 9.99681 13.523 numMergedOcc 0
25 mol 288 unq 0 iso 1 dist 7.64453 4.60276 9.99681 14.1553 9.62446 13.523 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 7.64453 14.1553 9.62446 4.60276 9.99681 13.523 numMergedOcc 0
27 mol 289 unq 0 iso 1 dist 7.64453 4.60276 9.99681 14.1553 9.62446 13.523 numMergedOcc 0
