0 mol 25 unq 0 iso 0 dist 8.58806 9.58408 9.04546 9.27448 7.15972 13.804 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 8.58806 9.58408 9.04546 9.07927 12.1122 16.653 numMergedOcc 0
2 mol 25 unq 2 iso 0 dist 8.58806 9.58408 9.04546 8.50987 14.3338 16.4918 numMergedOcc 0
3 mol 63 unq 0 iso 0 dist 8.23695 8.1123 10.6342 8.74231 13.2118 15.2214 numMergedOcc 0
4 mol 63 unq 1 iso 0 dist 7.04212 8.1123 5.97055 8.74231 10.7769 15.2214 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 4.3761 3.90209 8.19607 9.58693 8.91618 12.3572 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 4.3761 3.90209 8.19607 9.48388 12.3835 7.71768 numMergedOcc 0
7 mol 98 unq 2 iso 0 dist 5.84583 3.90209 4.67787 9.58693 12.9994 12.3572 numMergedOcc 0
8 mol 98 unq 3 iso 0 dist 5.84583 3.90209 4.67787 9.48388 4.96747 7.71768 numMergedOcc 0
9 mol 100 unq 0 iso 0 dist 8.08937 5.72842 10.1337 7.02792 3.9675 7.68675 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 9.87066 8.91629 10.1507 6.44766 5.59449 5.29825 numMergedOcc 0
11 mol 171 unq 0 iso 0 dist 8.30819 4.46397 12.1824 8.68992 10.5731 9.02044 numMergedOcc 0
12 mol 173 unq 0 iso 0 dist 8.91036 8.82137 16.1177 9.72828 10.8336 9.29369 numMergedOcc 0
13 mol 180 unq 0 iso 0 dist 9.13402 7.11542 7.28833 7.24785 10.2567 6.93557 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.37765 9.92602 8.95042 6.20985 4.94882 5.93294 numMergedOcc 0
15 mol 213 unq 0 iso 0 dist 6.02401 6.07688 6.05671 8.67044 4.70115 5.29742 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 9.22999 6.99973 9.87475 5.07968 5.38988 6.81956 numMergedOcc 0
17 mol 222 unq 0 iso 0 dist 6.17749 8.27605 6.45821 8.81925 4.82768 11.2593 numMergedOcc 0
18 mol 233 unq 0 iso 0 dist 8.73545 7.67027 15.6432 4.94074 6.52848 9.8029 numMergedOcc 0
19 mol 233 unq 1 iso 0 dist 8.14581 7.67027 10.9337 4.94074 5.51 9.8029 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 5.67249 8.70264 7.26273 8.58958 10.3064 7.01488 numMergedOcc 0
21 mol 234 unq 1 iso 0 dist 5.67249 8.70264 7.26273 7.17987 6.50055 7.54044 numMergedOcc 0
22 mol 292 unq 0 iso 0 dist 6.38051 8.85233 5.43452 6.07571 9.00118 9.38462 numMergedOcc 0
23 mol 292 unq 1 iso 0 dist 6.38051 7.06322 8.10713 6.07571 9.00118 5.81799 numMergedOcc 0
