0 mol 8 unq 0 iso 0 dist 5.38703 8.16743 8.93691 4.81384 8.79697 6.26865 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 8.92491 6.57826 10.7901 6.47992 14.7923 9.46312 numMergedOcc 0
2 mol 99 unq 0 iso 0 dist 5.61946 4.74654 6.83905 6.40485 11.2459 6.6925 numMergedOcc 0
3 mol 99 unq 1 iso 0 dist 5.61946 4.74654 6.83905 4.42043 9.58975 7.12746 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 5.82456 6.96057 8.67095 9.24319 14.0094 9.49413 numMergedOcc 0
5 mol 114 unq 1 iso 0 dist 5.82456 9.78437 11.5584 12.1715 16.9342 8.87941 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 5.84909 8.9344 5.28979 6.2062 7.46812 5.99299 numMergedOcc 0
7 mol 155 unq 0 iso 0 dist 9.25488 8.02593 8.59213 5.92486 13.1102 7.37901 numMergedOcc 0
8 mol 155 unq 1 iso 0 dist 8.02356 8.02593 6.6805 5.92486 11.4383 7.37901 numMergedOcc 0
9 mol 155 unq 2 iso 0 dist 9.22494 7.62575 10.225 4.40049 13.0413 7.37901 numMergedOcc 0
10 mol 173 unq 0 iso 0 dist 6.60418 9.56248 13.5257 18.0449 22.9491 9.79554 numMergedOcc 0
11 mol 175 unq 0 iso 0 dist 8.57666 9.00025 16.553 6.33235 14.8374 6.74517 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 8.90161 9.15368 6.72205 4.24915 5.89833 8.20656 numMergedOcc 0
13 mol 181 unq 1 iso 0 dist 8.90161 7.96182 10.7557 4.24915 5.89833 9.40622 numMergedOcc 0
14 mol 233 unq 0 iso 0 dist 9.44671 7.83363 13.091 11.8509 19.6009 9.2911 numMergedOcc 0
15 mol 233 unq 1 iso 0 dist 7.21531 7.83363 10.3247 11.8509 17.2533 9.2911 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 7.15878 5.648 7.14566 6.21932 12.8655 8.53287 numMergedOcc 0
17 mol 243 unq 0 iso 0 dist 8.6336 6.9453 4.54892 4.12468 11.806 8.93338 numMergedOcc 0
18 mol 243 unq 1 iso 0 dist 9.58608 6.9453 12.6292 4.12468 8.62303 8.93338 numMergedOcc 0
