0 mol 70 unq 0 iso 0 dist 5.94235 5.89083 6.54023 10.341 9.03317 9.65964 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 7.61883 13.4243 8.85586 21.3318 14.8866 8.70481 numMergedOcc 0
2 mol 94 unq 0 iso 0 dist 7.04255 7.1623 9.97569 8.96022 5.60279 7.89459 numMergedOcc 0
3 mol 94 unq 1 iso 0 dist 7.46708 8.92413 9.97569 8.75181 5.60279 7.89459 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 9.71246 5.21064 6.43433 5.43031 8.56707 7.71338 numMergedOcc 0
5 mol 112 unq 1 iso 0 dist 9.71246 9.27307 9.92283 17.8819 17.3924 9.60462 numMergedOcc 0
6 mol 131 unq 0 iso 0 dist 7.2882 13.0713 8.86329 12.0206 5.89022 8.40312 numMergedOcc 0
7 mol 131 unq 1 iso 0 dist 7.2882 11.4089 8.71039 12.0206 5.89022 7.12972 numMergedOcc 0
8 mol 131 unq 2 iso 0 dist 7.29431 11.4089 6.92648 12.0206 9.32969 7.12972 numMergedOcc 0
9 mol 131 unq 3 iso 0 dist 7.29431 15.3289 9.29384 12.0206 9.32969 6.85062 numMergedOcc 0
10 mol 131 unq 4 iso 0 dist 5.5811 6.84632 6.92648 10.3516 9.32969 7.12972 numMergedOcc 0
11 mol 131 unq 5 iso 0 dist 5.5811 6.24204 9.29384 10.3516 9.32969 6.85062 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 7.84979 11.6923 6.76699 6.2109 5.74088 6.29155 numMergedOcc 0
13 mol 156 unq 0 iso 0 dist 7.61925 12.0888 9.43259 11.6132 6.44255 8.34702 numMergedOcc 0
14 mol 210 unq 0 iso 0 dist 8.2847 5.42209 5.37446 7.08106 9.59996 6.18308 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 8.72988 6.96634 8.46327 14.8762 10.2399 8.82096 numMergedOcc 0
16 mol 272 unq 0 iso 0 dist 9.13006 14.5343 9.64269 10.7336 4.86504 9.97651 numMergedOcc 0
17 mol 272 unq 1 iso 0 dist 9.13006 7.59176 8.46061 9.32985 8.7909 8.33638 numMergedOcc 0
18 mol 272 unq 2 iso 0 dist 9.13006 7.59176 8.46061 10.7336 4.86504 8.46116 numMergedOcc 0
19 mol 272 unq 3 iso 0 dist 8.42563 10.4754 9.64269 5.50002 4.86504 9.97651 numMergedOcc 0
20 mol 272 unq 4 iso 0 dist 8.42563 12.6468 8.46061 10.0329 8.7909 8.33638 numMergedOcc 0
21 mol 272 unq 5 iso 0 dist 8.42563 12.6468 8.46061 5.50002 4.86504 8.46116 numMergedOcc 0
