0 mol 27 unq 0 iso 0 dist 6.68662 5.80623 5.92112 9.1735 13.3976 9.52474 numMergedOcc 0
1 mol 27 unq 1 iso 0 dist 9.11084 7.24775 5.92112 10.6901 13.3976 9.52474 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 5.97363 7.38868 3.72006 5.57159 7.09757 7.26024 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 5.97363 9.04129 5.2359 5.57159 7.09757 6.36086 numMergedOcc 0
4 mol 91 unq 0 iso 0 dist 9.13904 8.99674 12.1497 6.34706 13.1689 5.73743 numMergedOcc 0
5 mol 91 unq 1 iso 0 dist 7.10245 8.99674 9.73719 6.34706 11.1391 5.73743 numMergedOcc 0
6 mol 167 unq 0 iso 0 dist 9.08844 7.93807 9.40319 5.89138 5.72735 9.67741 numMergedOcc 0
7 mol 196 unq 0 iso 0 dist 8.94535 6.67699 3.68546 7.69186 10.0099 6.70531 numMergedOcc 0
8 mol 196 unq 1 iso 0 dist 8.94535 6.67699 3.68546 7.08535 6.11835 6.86319 numMergedOcc 0
9 mol 227 unq 0 iso 0 dist 9.92621 5.87056 5.78036 6.78651 9.68793 7.43071 numMergedOcc 0
10 mol 227 unq 1 iso 0 dist 9.92621 5.87056 5.78036 6.02375 6.40086 6.02296 numMergedOcc 0
11 mol 227 unq 2 iso 0 dist 9.92621 9.84311 14.7628 6.78651 9.68793 5.41321 numMergedOcc 0
12 mol 278 unq 0 iso 0 dist 6.95272 8.60481 7.27472 13.5463 11.5093 8.00673 numMergedOcc 0
13 mol 278 unq 1 iso 0 dist 6.95272 8.60481 7.27472 5.81569 5.77089 6.62841 numMergedOcc 0
14 mol 287 unq 0 iso 0 dist 7.86603 5.62568 5.41757 10.7971 9.29241 6.89451 numMergedOcc 0
15 mol 287 unq 1 iso 0 dist 7.17626 8.82948 5.41757 6.27066 9.29241 6.89451 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 7.86603 5.62568 5.41757 10.7971 9.29241 6.89451 numMergedOcc 0
17 mol 288 unq 1 iso 0 dist 7.17626 8.82948 5.41757 6.27066 9.29241 6.89451 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 7.86603 5.62568 5.41757 10.7971 9.29241 6.89451 numMergedOcc 0
19 mol 289 unq 1 iso 0 dist 7.17626 8.82948 5.41757 6.27066 9.29241 6.89451 numMergedOcc 0
