0 mol 42 unq 0 iso 0 dist 9.0802 9.50049 9.38166 4.33061 6.86731 11.3896 numMergedOcc 0
1 mol 78 unq 0 iso 0 dist 8.06502 6.09318 5.42987 5.56506 8.53393 9.95767 numMergedOcc 0
2 mol 78 unq 1 iso 0 dist 8.06502 6.09318 5.42987 4.81535 5.57265 5.68286 numMergedOcc 0
3 mol 78 unq 2 iso 0 dist 8.76115 6.09318 4.37747 4.81535 7.05258 5.68286 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 5.09725 6.00684 5.46484 4.98967 6.09906 8.0139 numMergedOcc 0
5 mol 100 unq 0 iso 0 dist 8.67615 8.96628 12.0237 5.06206 9.56324 9.27725 numMergedOcc 0
6 mol 147 unq 0 iso 0 dist 7.52211 9.89646 13.3408 6.97147 6.87299 9.88662 numMergedOcc 0
7 mol 217 unq 0 iso 0 dist 6.60582 6.10085 6.92631 7.93016 6.74267 6.23025 numMergedOcc 0
8 mol 238 unq 0 iso 0 dist 9.72321 9.28467 5.22512 15.1506 9.38753 14.3985 numMergedOcc 0
9 mol 241 unq 0 iso 0 dist 4.66398 5.42605 8.82095 7.9304 8.98668 10.7463 numMergedOcc 0
10 mol 258 unq 0 iso 0 dist 7.96325 6.77021 8.11944 5.29393 8.40766 11.1621 numMergedOcc 0
11 mol 274 unq 0 iso 0 dist 8.69635 9.65343 6.06272 4.29576 8.78883 10.7773 numMergedOcc 0
12 mol 280 unq 0 iso 0 dist 7.11605 8.71581 15.4342 14.3313 8.80588 21.2961 numMergedOcc 0
