0 mol 26 unq 0 iso 0 dist 8.69142 15.4279 8.43523 14.1116 7.3022 6.23975 numMergedOcc 0
1 mol 26 unq 0 iso 1 dist 8.43523 15.4279 8.69142 6.23975 7.3022 14.1116 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 8.12513 13.6588 6.9762 10.2582 6.61977 4.92196 numMergedOcc 0
3 mol 46 unq 0 iso 1 dist 6.9762 13.6588 8.12513 4.92196 6.61977 10.2582 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 5.21813 12.706 7.89276 4.34749 6.0129 13.6222 numMergedOcc 0
5 mol 98 unq 0 iso 1 dist 7.89276 12.706 5.21813 13.6222 6.0129 4.34749 numMergedOcc 0
6 mol 130 unq 0 iso 0 dist 7.35647 7.12648 4.88366 9.17181 6.90634 8.0835 numMergedOcc 0
7 mol 130 unq 0 iso 1 dist 4.88366 7.12648 7.35647 8.0835 6.90634 9.17181 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 9.29665 10.5002 5.08086 13.6142 6.87262 5.97803 numMergedOcc 0
9 mol 133 unq 0 iso 1 dist 5.08086 10.5002 9.29665 5.97803 6.87262 13.6142 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 7.85849 11.0847 6.08299 14.3338 8.55616 5.2893 numMergedOcc 0
11 mol 134 unq 0 iso 1 dist 6.08299 11.0847 7.85849 5.2893 8.55616 14.3338 numMergedOcc 0
12 mol 134 unq 1 iso 0 dist 7.85849 11.0847 6.08299 13.386 8.73604 11.8215 numMergedOcc 0
13 mol 134 unq 1 iso 1 dist 6.08299 11.0847 7.85849 11.8215 8.73604 13.386 numMergedOcc 0
14 mol 135 unq 0 iso 0 dist 5.95344 5.62327 7.8687 6.9257 9.15377 9.71714 numMergedOcc 0
15 mol 135 unq 0 iso 1 dist 7.8687 5.62327 5.95344 9.71714 9.15377 6.9257 numMergedOcc 0
16 mol 146 unq 0 iso 0 dist 8.73563 5.96795 9.64915 6.21982 6.50043 5.91626 numMergedOcc 0
17 mol 146 unq 0 iso 1 dist 9.64915 5.96795 8.73563 5.91626 6.50043 6.21982 numMergedOcc 0
18 mol 146 unq 1 iso 0 dist 6.4477 6.2175 7.92203 11.4615 9.44952 6.21982 numMergedOcc 0
19 mol 146 unq 1 iso 1 dist 7.92203 6.2175 6.4477 6.21982 9.44952 11.4615 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 6.19189 10.9361 8.34668 9.94791 9.84492 4.34714 numMergedOcc 0
21 mol 186 unq 0 iso 1 dist 8.34668 10.9361 6.19189 4.34714 9.84492 9.94791 numMergedOcc 0
22 mol 235 unq 0 iso 0 dist 8.08581 9.1359 5.98104 12.4324 6.54825 4.25998 numMergedOcc 0
23 mol 235 unq 0 iso 1 dist 5.98104 9.1359 8.08581 4.25998 6.54825 12.4324 numMergedOcc 0
