0 mol 5 unq 0 iso 0 dist 6.99733 9.13355 4.59167 12.1084 10.8072 9.22027 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 4.80247 7.89184 3.54989 10.8339 9.23105 7.53964 numMergedOcc 0
2 mol 56 unq 1 iso 0 dist 4.80247 7.89184 3.54989 7.01089 6.14494 5.76961 numMergedOcc 0
3 mol 56 unq 2 iso 0 dist 4.80247 5.91948 4.67834 7.01089 6.14494 9.47401 numMergedOcc 0
4 mol 56 unq 3 iso 0 dist 9.94735 5.62688 8.68463 9.25719 15.8233 8.77529 numMergedOcc 0
5 mol 56 unq 4 iso 0 dist 9.44388 5.62688 10.5328 9.25719 18.0871 8.77529 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 5.37449 8.8326 5.34337 7.15288 9.73179 9.59729 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 9.52666 8.8326 10.8827 7.15288 11.9664 9.59729 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 6.21554 9.58844 6.5713 13.9252 13.3329 7.5573 numMergedOcc 0
9 mol 184 unq 0 iso 0 dist 8.49577 9.07247 13.4486 9.35176 15.8333 4.61596 numMergedOcc 0
10 mol 197 unq 0 iso 0 dist 7.69352 6.66653 3.35829 8.55619 7.86042 6.69042 numMergedOcc 0
11 mol 198 unq 0 iso 0 dist 7.62505 9.85404 5.14649 18.8265 14.938 9.91727 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 8.27071 7.84418 10.4922 5.23547 7.53734 6.40171 numMergedOcc 0
13 mol 205 unq 1 iso 0 dist 8.63185 6.92823 6.22981 9.39472 8.92597 6.40171 numMergedOcc 0
14 mol 205 unq 2 iso 0 dist 7.25362 6.92823 4.7106 9.39472 9.40312 6.40171 numMergedOcc 0
15 mol 222 unq 0 iso 0 dist 5.17916 7.61739 6.4817 7.60854 7.99441 8.14294 numMergedOcc 0
16 mol 222 unq 1 iso 0 dist 5.17916 7.61739 6.4817 5.13817 6.71817 5.72 numMergedOcc 0
17 mol 222 unq 2 iso 0 dist 5.17916 7.61739 6.4817 4.54609 8.41524 6.84052 numMergedOcc 0
18 mol 222 unq 3 iso 0 dist 5.17916 9.59191 8.05936 4.54609 8.41524 9.58086 numMergedOcc 0
19 mol 235 unq 0 iso 0 dist 7.30003 6.50932 3.89748 7.4921 7.93194 6.03081 numMergedOcc 0
20 mol 235 unq 1 iso 0 dist 7.30003 6.50932 3.89748 4.7126 9.89352 7.41433 numMergedOcc 0
21 mol 238 unq 0 iso 0 dist 7.75366 5.41453 4.70535 4.48114 5.52788 4.66186 numMergedOcc 0
22 mol 264 unq 0 iso 0 dist 7.27155 7.05095 4.77242 8.52745 12.9073 9.78237 numMergedOcc 0
23 mol 264 unq 1 iso 0 dist 7.27155 7.05095 4.77242 5.39798 11.6354 9.70101 numMergedOcc 0
24 mol 264 unq 2 iso 0 dist 7.27155 7.05095 4.77242 4.96942 11.3594 9.95798 numMergedOcc 0
25 mol 279 unq 0 iso 0 dist 8.51994 5.41277 7.98069 4.1816 10.9344 5.02349 numMergedOcc 0
