0 mol 0 unq 0 iso 0 dist 7.31837 7.65884 8.34244 5.66453 6.64713 4.04089 9.42137 5.24778 9.23213 6.26831 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 9.8978 6.67398 9.57198 5.3866 8.076 6.81435 12.8762 9.5997 8.47421 8.83269 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 9.8978 6.67398 9.57198 10.6991 6.32226 13.6861 12.8762 9.5997 8.47421 15.5119 numMergedOcc 0
3 mol 9 unq 2 iso 0 dist 6.26276 9.03359 9.57198 6.49896 8.076 6.81435 13.0231 9.5997 8.47421 8.83269 numMergedOcc 0
4 mol 9 unq 3 iso 0 dist 6.26276 9.03359 9.57198 5.55187 6.32226 13.6861 13.0231 9.5997 8.47421 15.5119 numMergedOcc 0
5 mol 27 unq 0 iso 0 dist 5.66743 11.6846 7.60283 5.82138 7.45532 14.2471 19.7162 14.3929 9.77484 19.9619 numMergedOcc 0
6 mol 27 unq 1 iso 0 dist 7.42669 8.05284 7.60283 9.93763 7.45532 14.2471 16.4314 14.3929 9.77484 19.9619 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 5.84625 10.3974 7.6481 9.05877 6.62229 5.36808 15.1543 9.62267 8.81638 10.8014 numMergedOcc 0
8 mol 58 unq 1 iso 0 dist 5.84625 9.80755 9.11258 9.05877 6.62229 9.17656 9.01612 10.2049 8.63333 14.62 numMergedOcc 0
9 mol 58 unq 2 iso 0 dist 5.84625 9.80755 9.11258 9.05877 6.62229 9.17656 4.88613 5.49591 8.89374 10.9864 numMergedOcc 0
10 mol 58 unq 3 iso 0 dist 5.84625 9.80755 9.11258 9.05877 6.62229 9.17656 10.3132 5.85698 6.46761 7.27383 numMergedOcc 0
11 mol 58 unq 4 iso 0 dist 5.84625 9.80755 9.11258 9.05877 6.62229 9.17656 16.5848 12.2123 9.73139 12.5444 numMergedOcc 0
12 mol 100 unq 0 iso 0 dist 9.16592 7.62048 7.09065 15.7109 9.5669 10.2428 10.9136 9.36726 9.39469 16.8433 numMergedOcc 0
13 mol 100 unq 1 iso 0 dist 9.16592 7.62048 7.09065 15.7109 9.5669 10.2428 10.9561 7.16919 4.76815 10.8066 numMergedOcc 0
14 mol 114 unq 0 iso 0 dist 8.27794 8.32999 9.83981 11.393 9.35942 8.36453 13.0299 13.7032 6.73814 14.3116 numMergedOcc 0
15 mol 114 unq 1 iso 0 dist 8.27794 8.32999 9.83981 13.5888 7.42482 17.1979 13.0299 13.7032 6.73814 20.2915 numMergedOcc 0
16 mol 115 unq 0 iso 0 dist 6.66022 5.46352 5.60389 5.01124 8.85881 6.03931 4.98864 5.22052 6.99777 5.74857 numMergedOcc 0
17 mol 119 unq 0 iso 0 dist 8.4733 6.02826 7.26955 6.64646 9.9151 9.0892 7.91337 5.92984 7.39889 12.8231 numMergedOcc 0
18 mol 119 unq 1 iso 0 dist 8.4733 6.02826 7.26955 6.64646 9.9151 9.0892 11.7745 15.5019 9.63176 17.1697 numMergedOcc 0
19 mol 119 unq 2 iso 0 dist 8.4733 6.02826 7.26955 6.64646 9.9151 9.0892 13.3911 10.314 7.44174 15.0262 numMergedOcc 0
20 mol 126 unq 0 iso 0 dist 8.97111 4.56139 7.36017 5.93497 5.94233 5.83002 8.32241 6.0268 7.75534 9.46588 numMergedOcc 0
21 mol 126 unq 1 iso 0 dist 8.97111 4.56139 7.36017 5.93497 5.94233 5.83002 11.9998 10.1326 9.06011 13.4223 numMergedOcc 0
22 mol 173 unq 0 iso 0 dist 9.51638 12.905 6.64779 7.11509 8.03528 10.2821 14.0294 4.72839 7.93331 12.4422 numMergedOcc 0
23 mol 173 unq 1 iso 0 dist 9.51638 12.905 6.64779 7.11509 8.03528 10.2821 17.3029 8.07089 6.98095 14.5628 numMergedOcc 0
24 mol 173 unq 2 iso 0 dist 9.51638 12.905 6.64779 7.11509 8.03528 10.2821 12.2385 5.70743 8.31897 13.1902 numMergedOcc 0
25 mol 253 unq 0 iso 0 dist 9.69704 8.75798 9.58354 9.82329 8.15091 14.5407 7.15815 5.78064 7.19465 7.77998 numMergedOcc 0
26 mol 257 unq 0 iso 0 dist 9.34004 7.73649 8.60481 5.21929 9.43042 5.04668 12.6087 6.74593 7.27505 9.69696 numMergedOcc 0
