0 mol 25 unq 0 iso 0 dist 6.80822 5.33732 8.5404 10.985 8.53931 11.7199 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 6.59367 11.0096 5.52067 13.7087 7.29079 7.20383 numMergedOcc 0
2 mol 119 unq 0 iso 0 dist 6.36583 11.6071 9.87025 6.31352 6.13374 6.29394 numMergedOcc 0
3 mol 128 unq 0 iso 0 dist 9.11128 14.4727 9.89462 10.0983 6.47811 9.96803 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 6.61636 12.9327 9.4062 4.97581 9.10003 11.7892 numMergedOcc 0
5 mol 143 unq 0 iso 0 dist 8.22353 6.36527 6.40901 11.3315 8.18023 9.05786 numMergedOcc 0
6 mol 143 unq 1 iso 0 dist 8.22353 6.36527 6.40901 12.1494 7.46803 6.16103 numMergedOcc 0
7 mol 143 unq 2 iso 0 dist 8.22353 11.8891 9.40626 11.3315 8.18023 3.75378 numMergedOcc 0
8 mol 143 unq 3 iso 0 dist 8.22353 11.8891 9.40626 12.1494 7.46803 8.4697 numMergedOcc 0
9 mol 143 unq 4 iso 0 dist 8.57285 11.1239 6.40901 14.6282 8.18023 9.05786 numMergedOcc 0
10 mol 143 unq 5 iso 0 dist 8.57285 11.1239 6.40901 7.11802 7.46803 6.16103 numMergedOcc 0
11 mol 143 unq 6 iso 0 dist 8.57285 14.3979 9.40626 14.6282 8.18023 3.75378 numMergedOcc 0
12 mol 143 unq 7 iso 0 dist 8.57285 14.3979 9.40626 7.11802 7.46803 8.4697 numMergedOcc 0
13 mol 173 unq 0 iso 0 dist 7.33162 11.9409 7.54706 15.3642 8.62366 9.35572 numMergedOcc 0
14 mol 173 unq 1 iso 0 dist 7.33162 11.9409 7.54706 14.6996 9.44973 5.74438 numMergedOcc 0
15 mol 173 unq 2 iso 0 dist 7.33162 11.9409 7.54706 10.1636 6.52508 8.43374 numMergedOcc 0
16 mol 214 unq 0 iso 0 dist 6.96139 4.08418 7.2498 10.0389 9.58372 11.6757 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 6.40309 11.5358 7.61203 5.36582 7.39547 8.5378 numMergedOcc 0
18 mol 248 unq 0 iso 0 dist 9.83514 4.01898 8.53148 9.33595 5.0345 7.14182 numMergedOcc 0
19 mol 273 unq 0 iso 0 dist 7.96519 10.9098 6.94131 9.73521 9.35749 6.87067 numMergedOcc 0
20 mol 273 unq 1 iso 0 dist 7.96519 13.7674 9.84628 9.73521 9.35749 5.81024 numMergedOcc 0
