0 mol 11 unq 0 iso 0 dist 9.98578 10.5542 8.22997 17.6926 11.7321 7.90478 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 9.98578 10.5542 8.22997 11.983 5.97265 7.16561 numMergedOcc 0
2 mol 11 unq 2 iso 0 dist 8.08367 5.97492 8.22997 13.1858 11.7321 7.90478 numMergedOcc 0
3 mol 11 unq 3 iso 0 dist 8.08367 5.97492 8.22997 10.8395 5.97265 7.16561 numMergedOcc 0
4 mol 11 unq 4 iso 0 dist 7.19061 9.79813 8.22997 16.6094 11.7321 7.90478 numMergedOcc 0
5 mol 11 unq 5 iso 0 dist 7.19061 9.79813 8.22997 11.2833 5.97265 7.16561 numMergedOcc 0
6 mol 11 unq 6 iso 0 dist 9.14139 12.577 8.40993 18.0999 11.501 7.46578 numMergedOcc 0
7 mol 11 unq 7 iso 0 dist 9.14139 12.577 8.40993 14.4158 5.91043 7.16561 numMergedOcc 0
8 mol 11 unq 8 iso 0 dist 6.91808 9.53437 8.40993 15.8485 11.501 7.46578 numMergedOcc 0
9 mol 11 unq 9 iso 0 dist 6.91808 9.53437 8.40993 10.8487 5.91043 7.16561 numMergedOcc 0
10 mol 11 unq 10 iso 0 dist 5.87616 6.5069 8.23032 7.05626 4.24301 7.90478 numMergedOcc 0
11 mol 11 unq 11 iso 0 dist 5.87616 6.5069 8.23032 11.9259 10.4568 7.16561 numMergedOcc 0
12 mol 26 unq 0 iso 0 dist 7.04707 11.7206 9.32718 10.2269 4.03003 6.93197 numMergedOcc 0
13 mol 55 unq 0 iso 0 dist 8.61209 4.31691 6.66861 11.914 10.042 9.93096 numMergedOcc 0
14 mol 55 unq 1 iso 0 dist 5.7638 6.96815 6.66861 13.8817 10.042 9.93096 numMergedOcc 0
15 mol 55 unq 2 iso 0 dist 8.55679 6.96815 6.72084 13.8817 12.1572 9.93096 numMergedOcc 0
16 mol 79 unq 0 iso 0 dist 8.40399 6.0425 9.78129 10.2613 6.04442 8.03296 numMergedOcc 0
17 mol 79 unq 1 iso 0 dist 8.40399 6.0425 9.78129 11.3221 11.2226 9.26979 numMergedOcc 0
18 mol 91 unq 0 iso 0 dist 7.62621 5.75219 5.51406 4.86532 10.4949 8.66165 numMergedOcc 0
19 mol 93 unq 0 iso 0 dist 8.52947 14.4934 7.4518 22.6401 14.4094 8.89417 numMergedOcc 0
20 mol 93 unq 1 iso 0 dist 8.52947 14.4934 7.4518 18.0064 9.73718 9.95255 numMergedOcc 0
21 mol 93 unq 2 iso 0 dist 8.84466 16.0131 7.4518 21.0016 14.4094 8.89417 numMergedOcc 0
22 mol 93 unq 3 iso 0 dist 8.84466 16.0131 7.4518 13.0854 9.73718 9.95255 numMergedOcc 0
23 mol 133 unq 0 iso 0 dist 9.22456 8.11294 9.04845 12.2194 6.26174 8.95662 numMergedOcc 0
24 mol 133 unq 1 iso 0 dist 5.7232 8.11294 6.72323 12.2194 14.5316 8.95662 numMergedOcc 0
25 mol 181 unq 0 iso 0 dist 8.94464 6.15536 9.07527 5.87853 10.0344 7.22883 numMergedOcc 0
26 mol 244 unq 0 iso 0 dist 7.00974 7.72205 5.79898 9.96572 4.38246 6.22122 numMergedOcc 0
27 mol 247 unq 0 iso 0 dist 8.72346 5.81946 6.18065 13.1857 10.7268 8.45756 numMergedOcc 0
28 mol 247 unq 1 iso 0 dist 7.39069 11.7687 6.18065 16.9982 10.7268 8.45756 numMergedOcc 0
29 mol 292 unq 0 iso 0 dist 5.76223 4.34945 6.68863 10.0782 10.8497 8.25485 numMergedOcc 0
