0 mol 7 unq 0 iso 0 dist 8.8576 10.4545 8.41585 12.5865 7.15287 6.22892 15.8224 13.8674 6.3027 8.41173 numMergedOcc 0
1 mol 51 unq 0 iso 0 dist 8.99612 10.2637 9.0709 18.4693 12.8917 9.06397 15.1585 13.9156 5.27155 7.95419 numMergedOcc 0
2 mol 60 unq 0 iso 0 dist 8.46609 12.4802 6.43294 20.4977 12.5818 8.8058 16.4895 11.8302 6.0993 9.54864 numMergedOcc 0
3 mol 75 unq 0 iso 0 dist 8.64872 10.4239 7.79912 12.9364 5.06305 7.118 15.6549 10.6919 6.33557 7.89636 numMergedOcc 0
4 mol 75 unq 1 iso 0 dist 8.64872 10.4239 7.79912 12.9364 5.06305 7.118 16.4982 11.1009 9.95193 9.49608 numMergedOcc 0
5 mol 75 unq 2 iso 0 dist 8.64872 12.0967 8.56639 12.9364 5.06305 8.24814 15.6549 10.6919 4.67917 7.89636 numMergedOcc 0
6 mol 75 unq 3 iso 0 dist 8.64872 12.0967 8.56639 12.9364 5.06305 8.24814 16.4982 11.1009 5.10798 9.49608 numMergedOcc 0
7 mol 127 unq 0 iso 0 dist 8.09965 8.45411 8.14887 14.4763 10.345 6.65963 11.1972 12.4667 5.38 8.98151 numMergedOcc 0
8 mol 127 unq 1 iso 0 dist 8.09965 11.3174 9.30299 14.4763 10.345 8.62711 11.1972 12.4667 6.75619 8.98151 numMergedOcc 0
9 mol 248 unq 0 iso 0 dist 9.5107 11.8955 7.69895 16.6942 9.48478 6.44967 10.5215 8.71859 4.53213 8.11968 numMergedOcc 0
10 mol 259 unq 0 iso 0 dist 5.29682 5.56656 8.13497 10.549 10.908 6.96379 4.98212 6.77279 5.71237 6.76656 numMergedOcc 0
11 mol 259 unq 1 iso 0 dist 6.20344 5.56656 7.88519 10.549 12.7595 6.96379 4.98212 9.58006 5.71237 6.76656 numMergedOcc 0
12 mol 261 unq 0 iso 0 dist 9.45818 13.2478 8.45658 20.6107 13.6041 7.6414 22.364 17.2791 11.544 9.70222 numMergedOcc 0
13 mol 265 unq 0 iso 0 dist 6.78702 4.75685 8.4218 8.43749 12.5953 7.54805 13.7732 15.5946 15.4199 9.56472 numMergedOcc 0
14 mol 265 unq 1 iso 0 dist 6.78702 4.75685 8.4218 8.43749 12.5953 7.54805 11.9238 17.4584 12.4903 6.5072 numMergedOcc 0
15 mol 265 unq 2 iso 0 dist 6.78702 4.75685 8.4218 8.43749 12.5953 7.54805 6.97261 12.3211 5.11366 4.03921 numMergedOcc 0
16 mol 265 unq 3 iso 0 dist 8.59825 11.5105 8.4218 11.3648 12.5953 7.54805 10.6329 15.5946 15.4199 9.56472 numMergedOcc 0
17 mol 265 unq 4 iso 0 dist 8.59825 11.5105 8.4218 11.3648 12.5953 7.54805 13.1443 17.4584 12.4903 6.5072 numMergedOcc 0
18 mol 265 unq 5 iso 0 dist 8.59825 11.5105 8.4218 11.3648 12.5953 7.54805 12.1799 12.3211 5.11366 4.03921 numMergedOcc 0
19 mol 280 unq 0 iso 0 dist 9.0021 12.6862 6.53701 20.1746 12.0417 8.27417 16.5706 11.1402 4.95798 7.3304 numMergedOcc 0
