0 mol 48 unq 0 iso 0 dist 7.55854 6.17165 7.34462 12.2035 7.52915 14.1179 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 5.48669 8.96284 7.34462 6.97305 7.52915 14.1179 numMergedOcc 0
2 mol 79 unq 0 iso 0 dist 7.18358 7.83159 9.0655 5.81115 6.96066 9.60958 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 4.3761 8.01128 10.9027 6.41542 8.04448 3.59451 numMergedOcc 0
4 mol 168 unq 0 iso 0 dist 8.80094 6.8754 11.6784 11.4575 8.35869 15.0972 numMergedOcc 0
5 mol 168 unq 1 iso 0 dist 8.07126 9.08545 11.6784 7.61088 8.35869 15.0972 numMergedOcc 0
6 mol 180 unq 0 iso 0 dist 8.65601 9.99021 7.69346 13.9919 9.26812 8.86377 numMergedOcc 0
7 mol 180 unq 1 iso 0 dist 6.33325 8.26428 7.69346 3.72291 9.26812 8.86377 numMergedOcc 0
8 mol 180 unq 2 iso 0 dist 5.78414 9.99021 10.5619 9.57014 9.19555 18.5737 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 5.39622 9.43816 9.45075 3.77738 8.52322 8.40343 numMergedOcc 0
10 mol 209 unq 0 iso 0 dist 9.53923 8.93728 6.9812 6.61665 9.39076 9.56015 numMergedOcc 0
11 mol 232 unq 0 iso 0 dist 8.15743 7.38809 8.47021 6.92292 8.21479 4.46314 numMergedOcc 0
12 mol 239 unq 0 iso 0 dist 7.45786 6.35005 13.6346 11.9127 9.87224 15.2222 numMergedOcc 0
13 mol 239 unq 1 iso 0 dist 7.45786 6.97325 5.66619 11.9127 9.87224 14.948 numMergedOcc 0
14 mol 239 unq 2 iso 0 dist 7.45786 6.36178 4.99161 11.9127 9.87224 12.5656 numMergedOcc 0
15 mol 258 unq 0 iso 0 dist 9.44043 9.41308 5.62491 6.69333 5.53473 9.26487 numMergedOcc 0
16 mol 258 unq 1 iso 0 dist 5.3435 6.6688 5.62491 8.08381 5.53473 9.26487 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 4.76689 7.246 8.55761 5.42082 6.23198 8.3298 numMergedOcc 0
18 mol 260 unq 1 iso 0 dist 7.26455 7.246 5.33348 5.42082 8.82216 8.3298 numMergedOcc 0
