0 mol 30 unq 0 iso 0 dist 9.28146 5.31555 8.91529 11.0624 8.21763 7.24295 numMergedOcc 0
1 mol 85 unq 0 iso 0 dist 8.52436 6.87788 6.2454 8.83135 10.8586 5.79841 numMergedOcc 0
2 mol 116 unq 0 iso 0 dist 8.28931 4.44169 8.75205 8.03113 3.82942 6.63731 numMergedOcc 0
3 mol 126 unq 0 iso 0 dist 9.93116 7.68024 9.52509 6.62527 3.77183 6.39634 numMergedOcc 0
4 mol 148 unq 0 iso 0 dist 8.09064 6.51997 5.20262 9.77704 3.92992 7.32163 numMergedOcc 0
5 mol 148 unq 1 iso 0 dist 9.87654 9.60966 5.20262 13.7713 3.92992 7.32163 numMergedOcc 0
6 mol 150 unq 0 iso 0 dist 8.00956 6.53628 5.21792 10.0084 3.94762 7.42372 numMergedOcc 0
7 mol 150 unq 1 iso 0 dist 9.90415 9.63513 5.21792 13.8352 3.94762 7.42372 numMergedOcc 0
8 mol 214 unq 0 iso 0 dist 8.89981 11.4982 5.79617 11.7756 3.91276 7.43301 numMergedOcc 0
9 mol 217 unq 0 iso 0 dist 6.58871 10.8948 5.27487 15.365 9.33845 9.37899 numMergedOcc 0
10 mol 217 unq 1 iso 0 dist 6.58871 10.8948 5.27487 15.9489 9.98266 6.14304 numMergedOcc 0
11 mol 223 unq 0 iso 0 dist 7.27963 11.4317 8.85178 16.0359 10.5752 6.64193 numMergedOcc 0
12 mol 223 unq 1 iso 0 dist 7.27963 4.44076 5.50267 10.6382 6.14747 8.12403 numMergedOcc 0
13 mol 236 unq 0 iso 0 dist 9.67162 10.1358 6.92437 13.0663 9.9308 9.85348 numMergedOcc 0
14 mol 279 unq 0 iso 0 dist 5.61134 9.69939 5.60922 5.94449 3.70525 6.12347 numMergedOcc 0
15 mol 279 unq 1 iso 0 dist 5.61134 9.69939 5.60922 8.61452 5.61412 8.79637 numMergedOcc 0
16 mol 283 unq 0 iso 0 dist 9.83098 7.77415 4.86946 10.9113 3.97454 6.72935 numMergedOcc 0
