0 mol 13 unq 0 iso 0 dist 5.99004 4.42362 9.57675 6.00386 7.98679 6.67016 numMergedOcc 0
1 mol 13 unq 1 iso 0 dist 5.99004 12.4066 8.84159 6.00386 7.98679 14.442 numMergedOcc 0
2 mol 13 unq 2 iso 0 dist 9.65051 14.6855 9.57675 9.78622 7.98679 6.67016 numMergedOcc 0
3 mol 13 unq 3 iso 0 dist 9.65051 8.31354 8.84159 9.78622 7.98679 14.442 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 8.67118 12.8082 6.34966 11.7387 8.91427 6.48823 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 6.04768 6.14241 4.96613 10.8678 6.62972 6.4628 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 9.40173 10.8152 4.96613 13.5865 6.62972 6.4628 numMergedOcc 0
7 mol 100 unq 0 iso 0 dist 6.36749 13.5986 9.95103 10.3606 9.5669 6.04919 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 8.05937 4.92027 6.13508 5.53632 9.9151 7.09096 numMergedOcc 0
9 mol 119 unq 1 iso 0 dist 9.21645 5.94065 5.58734 8.22571 7.12072 6.40944 numMergedOcc 0
10 mol 130 unq 0 iso 0 dist 6.87196 8.28869 5.96506 11.923 9.13191 9.65804 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 7.38183 13.1656 7.35385 10.8036 6.73983 12.6656 numMergedOcc 0
12 mol 141 unq 1 iso 0 dist 7.38183 13.1656 7.35385 12.1363 8.6387 14.7644 numMergedOcc 0
13 mol 152 unq 0 iso 0 dist 9.18176 11.1431 9.62138 7.65994 5.06613 10.149 numMergedOcc 0
14 mol 152 unq 1 iso 0 dist 9.18176 6.51929 5.11444 7.65994 5.06613 5.77969 numMergedOcc 0
15 mol 163 unq 0 iso 0 dist 8.68243 5.82716 9.57242 13.082 9.79069 13.5919 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 8.09667 4.29134 9.53805 5.37893 5.45675 8.99916 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 7.58118 11.0161 9.05637 6.71715 5.37796 8.06536 numMergedOcc 0
18 mol 226 unq 0 iso 0 dist 6.82883 16.1524 9.61639 7.21532 6.26945 11.7881 numMergedOcc 0
19 mol 226 unq 1 iso 0 dist 8.22518 15.429 9.61639 12.0613 6.26945 11.7881 numMergedOcc 0
20 mol 226 unq 2 iso 0 dist 6.02803 5.77365 9.61639 10.6196 6.26945 11.7881 numMergedOcc 0
21 mol 227 unq 0 iso 0 dist 8.91452 10.9434 7.17024 5.98458 7.95359 11.481 numMergedOcc 0
22 mol 248 unq 0 iso 0 dist 8.80866 8.02302 8.53033 9.94694 7.97135 12.2076 numMergedOcc 0
23 mol 285 unq 0 iso 0 dist 9.23037 5.77313 9.56169 11.8168 6.74142 10.36 numMergedOcc 0
24 mol 285 unq 1 iso 0 dist 9.23037 14.2829 8.02964 11.8168 6.74142 6.6406 numMergedOcc 0
