0 mol 17 unq 0 iso 0 dist 8.19749 9.99682 8.15305 9.84612 10.2527 16.4343 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 8.19749 9.99682 8.15305 9.31884 4.61249 5.95539 numMergedOcc 0
2 mol 17 unq 2 iso 0 dist 8.19749 9.38298 14.049 9.84612 10.2527 16.9932 numMergedOcc 0
3 mol 17 unq 3 iso 0 dist 8.19749 9.38298 14.049 9.31884 4.61249 12.7736 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 6.9084 9.77244 9.43583 8.55279 9.31682 3.85789 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 3.90209 7.40481 10.386 9.66226 8.83348 16.4222 numMergedOcc 0
6 mol 99 unq 0 iso 0 dist 8.0642 9.49001 5.25531 8.78215 6.00234 10.3245 numMergedOcc 0
7 mol 100 unq 0 iso 0 dist 5.72842 9.25746 7.2371 8.11279 11.4018 9.64716 numMergedOcc 0
8 mol 171 unq 0 iso 0 dist 6.01062 7.38306 8.33568 8.53734 9.46427 14.1926 numMergedOcc 0
9 mol 171 unq 1 iso 0 dist 8.63202 7.38306 9.88447 8.53734 9.21862 14.1926 numMergedOcc 0
10 mol 233 unq 0 iso 0 dist 7.67027 5.9677 8.47654 5.83278 5.67483 5.93475 numMergedOcc 0
11 mol 239 unq 0 iso 0 dist 4.88851 9.95565 5.44677 8.68931 4.76575 5.19631 numMergedOcc 0
12 mol 239 unq 1 iso 0 dist 7.65486 9.95565 12.3239 8.68931 7.79709 5.19631 numMergedOcc 0
13 mol 241 unq 0 iso 0 dist 8.67571 8.92649 5.4733 5.50061 5.71704 9.30696 numMergedOcc 0
14 mol 243 unq 0 iso 0 dist 8.90779 6.77411 6.20372 7.24253 12.9425 13.3958 numMergedOcc 0
15 mol 243 unq 1 iso 0 dist 8.90779 6.77411 6.20372 7.83742 6.23992 3.89742 numMergedOcc 0
16 mol 271 unq 0 iso 0 dist 7.88092 8.56431 10.0049 8.97962 13.0448 4.17949 numMergedOcc 0
17 mol 275 unq 0 iso 0 dist 9.80175 9.88669 7.67399 6.88967 4.96922 5.84903 numMergedOcc 0
