0 mol 1 unq 0 iso 0 dist 9.76602 7.35566 6.26921 9.77112 7.46399 5.30121 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 4.38047 12.1383 9.20373 4.94741 5.7405 8.97716 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 7.07989 7.11791 8.67118 7.13073 6.34966 12.8082 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 9.77272 10.2318 8.67118 13.7884 6.34966 12.8082 numMergedOcc 0
4 mol 100 unq 0 iso 0 dist 9.16592 10.4955 6.36749 14.9354 9.95103 13.5986 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 8.4733 9.90172 8.05937 9.73554 6.13508 4.92027 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 6.16862 11.9102 9.93309 8.83212 5.80404 4.83663 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 9.70325 13.067 9.93309 11.075 5.80404 4.83663 numMergedOcc 0
8 mol 163 unq 0 iso 0 dist 7.81715 7.9441 8.68243 5.05407 9.57242 5.82716 numMergedOcc 0
9 mol 175 unq 0 iso 0 dist 7.42278 9.47052 9.92784 8.62822 8.57607 8.21142 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 7.58256 9.4381 8.09667 12.9239 9.53805 4.29134 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 7.4513 11.1507 7.58118 5.13031 9.05637 11.0161 numMergedOcc 0
12 mol 226 unq 0 iso 0 dist 7.04477 12.8829 6.82883 5.02367 9.61639 16.1524 numMergedOcc 0
13 mol 226 unq 1 iso 0 dist 7.04477 14.6433 8.22518 5.02367 9.61639 15.429 numMergedOcc 0
14 mol 226 unq 2 iso 0 dist 7.04477 7.06868 6.02803 5.02367 9.61639 5.77365 numMergedOcc 0
15 mol 232 unq 0 iso 0 dist 9.41148 5.18593 6.71099 8.30148 9.92671 6.26321 numMergedOcc 0
16 mol 233 unq 0 iso 0 dist 9.73592 9.31629 8.76329 6.04517 9.82733 10.9953 numMergedOcc 0
17 mol 285 unq 0 iso 0 dist 8.76332 15.3037 9.23037 13.6976 9.56169 5.77313 numMergedOcc 0
18 mol 285 unq 1 iso 0 dist 8.76332 15.3037 9.23037 6.52069 8.02964 14.2829 numMergedOcc 0
