0 mol 11 unq 0 iso 0 dist 6.97875 11.2336 6.79478 11.0863 7.27724 8.3846 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 6.85305 6.71226 6.87871 6.72467 6.29127 8.82122 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 9.99634 10.8964 6.6003 11.9691 5.68303 9.14856 numMergedOcc 0
3 mol 64 unq 1 iso 0 dist 9.99634 10.8964 6.6003 10.2533 4.94316 4.97843 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 8.24121 7.48749 9.74996 11.7478 13.0324 6.21735 numMergedOcc 0
5 mol 69 unq 1 iso 0 dist 8.24121 7.48749 9.74996 5.29487 11.1718 7.78321 numMergedOcc 0
6 mol 69 unq 2 iso 0 dist 8.52371 7.48749 8.21667 11.7478 6.75422 6.21735 numMergedOcc 0
7 mol 69 unq 3 iso 0 dist 8.52371 7.48749 8.21667 5.29487 5.16281 7.78321 numMergedOcc 0
8 mol 69 unq 4 iso 0 dist 7.9097 7.45147 9.90199 7.06542 4.77089 6.21735 numMergedOcc 0
9 mol 69 unq 5 iso 0 dist 7.9097 7.45147 9.90199 14.3571 12.9801 7.78321 numMergedOcc 0
10 mol 102 unq 0 iso 0 dist 7.48277 5.51997 9.43411 6.793 4.32286 9.50209 numMergedOcc 0
11 mol 102 unq 1 iso 0 dist 9.0361 5.51997 9.80678 6.793 5.498 9.50209 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 6.09472 5.14617 6.86946 8.81198 5.60178 5.52706 numMergedOcc 0
13 mol 115 unq 1 iso 0 dist 8.93552 11.6665 6.86946 12.1661 5.60178 5.52706 numMergedOcc 0
14 mol 115 unq 2 iso 0 dist 6.20658 9.9398 6.86946 11.3523 5.60178 5.52706 numMergedOcc 0
15 mol 127 unq 0 iso 0 dist 7.73139 14.0161 8.40046 17.6467 14.085 8.03243 numMergedOcc 0
16 mol 127 unq 1 iso 0 dist 6.66607 6.39358 8.40046 10.9741 14.085 8.03243 numMergedOcc 0
17 mol 127 unq 2 iso 0 dist 8.62711 15.8417 8.40046 18.5156 14.085 8.03243 numMergedOcc 0
18 mol 140 unq 0 iso 0 dist 5.44596 8.91817 9.93572 10.9743 8.17877 7.79467 numMergedOcc 0
19 mol 155 unq 0 iso 0 dist 6.53758 5.2941 7.02715 8.54318 5.77564 5.64806 numMergedOcc 0
20 mol 182 unq 0 iso 0 dist 9.36307 4.39505 7.86625 12.0424 11.1088 9.23118 numMergedOcc 0
21 mol 206 unq 0 iso 0 dist 7.0119 8.77652 9.72979 9.5964 4.8585 8.42763 numMergedOcc 0
22 mol 214 unq 0 iso 0 dist 9.40003 10.6403 8.49704 13.7287 6.67959 6.35728 numMergedOcc 0
23 mol 214 unq 1 iso 0 dist 8.68385 15.7236 8.49704 10.7631 6.67959 6.35728 numMergedOcc 0
24 mol 222 unq 0 iso 0 dist 7.27481 4.56782 8.7347 7.46845 7.61682 5.04916 numMergedOcc 0
25 mol 224 unq 0 iso 0 dist 4.79841 6.4556 6.56437 8.15582 5.70973 8.7868 numMergedOcc 0
26 mol 224 unq 1 iso 0 dist 4.79841 5.66462 6.23882 8.15582 5.70973 4.64336 numMergedOcc 0
27 mol 224 unq 2 iso 0 dist 4.79841 9.46589 9.34636 11.4157 7.98696 8.60781 numMergedOcc 0
28 mol 258 unq 0 iso 0 dist 9.67877 9.0655 5.73296 15.1714 5.95565 9.09553 numMergedOcc 0
29 mol 273 unq 0 iso 0 dist 6.54753 4.62586 8.90885 6.59786 4.89568 6.8391 numMergedOcc 0
30 mol 273 unq 1 iso 0 dist 6.54753 4.62586 8.90885 7.96519 11.5447 6.06557 numMergedOcc 0
