0 mol 54 unq 0 iso 0 dist 6.50287 7.51978 11.6633 10.3758 8.30888 14.5828 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 5.3931 6.27528 6.08842 7.90431 9.4079 13.6994 numMergedOcc 0
2 mol 100 unq 0 iso 0 dist 9.81202 5.09688 8.71142 6.16378 8.96048 7.12017 numMergedOcc 0
3 mol 100 unq 1 iso 0 dist 9.27056 9.91446 6.27843 5.69359 8.96048 10.8066 numMergedOcc 0
4 mol 100 unq 2 iso 0 dist 9.27056 9.26343 8.71142 5.69359 8.96048 7.12017 numMergedOcc 0
5 mol 141 unq 0 iso 0 dist 8.43061 4.93035 7.862 5.74529 6.78772 6.69515 numMergedOcc 0
6 mol 141 unq 1 iso 0 dist 8.43061 9.75558 5.64577 5.74529 6.78772 7.86572 numMergedOcc 0
7 mol 143 unq 0 iso 0 dist 4.31989 6.7319 4.76513 5.52955 7.23619 11.0311 numMergedOcc 0
8 mol 153 unq 0 iso 0 dist 6.81821 9.79001 5.55828 11.6636 7.87611 11.5985 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 5.78397 6.64164 5.89138 6.93918 8.28222 12.625 numMergedOcc 0
10 mol 167 unq 1 iso 0 dist 5.36359 4.93984 6.7811 6.31396 8.28222 9.94125 numMergedOcc 0
11 mol 196 unq 0 iso 0 dist 7.18149 6.64506 4.21235 5.39297 8.3042 5.85777 numMergedOcc 0
12 mol 213 unq 0 iso 0 dist 8.17498 9.40939 12.2488 11.1386 9.10236 18.2674 numMergedOcc 0
13 mol 213 unq 1 iso 0 dist 8.17498 9.06306 17.0455 11.1386 9.10236 18.8194 numMergedOcc 0
14 mol 213 unq 2 iso 0 dist 8.17498 4.71403 7.21368 9.01127 7.5552 11.1286 numMergedOcc 0
15 mol 213 unq 3 iso 0 dist 8.17498 4.71403 7.21368 14.0772 8.10336 14.7151 numMergedOcc 0
16 mol 294 unq 0 iso 0 dist 9.62809 7.1984 12.3326 14.0753 9.99345 12.1586 numMergedOcc 0
