0 mol 73 unq 0 iso 0 dist 8.70133 9.73086 6.15714 5.4148 4.65521 7.4369 7.04044 11.2505 7.8972 8.73253 numMergedOcc 0
1 mol 73 unq 1 iso 0 dist 4.65521 7.4369 6.15714 5.4148 8.70133 9.73086 8.73253 11.2505 7.8972 7.04044 numMergedOcc 0
2 mol 73 unq 2 iso 0 dist 7.13087 5.61588 8.97361 8.07446 13.6145 5.5087 5.16364 5.69513 5.50891 8.85586 numMergedOcc 0
3 mol 73 unq 3 iso 0 dist 7.13087 5.61588 8.97361 8.07446 13.6145 5.5087 11.2874 13.4338 7.50869 7.11 numMergedOcc 0
4 mol 73 unq 4 iso 0 dist 7.13087 7.83244 10.2983 8.07446 13.6145 6.08682 5.16364 5.69513 4.75954 8.85586 numMergedOcc 0
5 mol 73 unq 5 iso 0 dist 7.13087 7.83244 10.2983 8.07446 13.6145 6.08682 11.2874 13.4338 3.6807 7.11 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 6.21982 6.72869 4.00608 10.2879 8.19682 9.85905 13.187 8.83525 11.0792 4.79949 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 6.21982 6.72869 4.00608 10.2879 8.19682 9.85905 11.2278 5.77727 6.48293 7.27693 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 9.66954 6.39384 6.49835 7.69052 8.66155 9.42082 10.9734 5.87507 10.5109 5.72642 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 7.64585 6.39384 5.65471 7.69052 12.2309 9.42082 10.9734 15.1897 10.5109 5.72642 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 8.79571 7.21868 5.67107 5.62899 13.0121 9.66543 8.20836 9.65798 4.935 7.36779 numMergedOcc 0
11 mol 134 unq 1 iso 0 dist 5.42582 7.93372 5.67107 10.7144 13.0121 9.66543 10.873 9.65798 4.935 7.36779 numMergedOcc 0
12 mol 134 unq 2 iso 0 dist 5.42582 7.93372 5.67107 5.49782 8.79571 7.21868 10.873 9.65798 4.935 8.20836 numMergedOcc 0
13 mol 142 unq 0 iso 0 dist 9.07935 6.14151 5.26247 5.32922 7.15475 7.81207 12.432 5.14959 9.38687 9.17106 numMergedOcc 0
14 mol 218 unq 0 iso 0 dist 8.53199 7.33709 11.6662 4.72474 12.0819 8.75536 5.76954 8.21424 6.57708 6.29367 numMergedOcc 0
15 mol 218 unq 1 iso 0 dist 8.53199 7.33709 11.6662 4.72474 12.0819 8.75536 6.29511 10.1198 13.4147 8.86175 numMergedOcc 0
16 mol 218 unq 2 iso 0 dist 8.53199 7.33709 11.6662 5.61978 13.6555 6.67404 5.76954 8.21424 6.57708 9.20961 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 5.50387 8.1945 3.92979 13.3965 9.88956 6.50998 11.5332 7.15437 6.35462 6.6561 numMergedOcc 0
18 mol 227 unq 0 iso 0 dist 9.62609 6.91318 11.5454 5.22356 13.4493 5.23634 5.4694 5.23507 7.3164 8.38865 numMergedOcc 0
19 mol 227 unq 1 iso 0 dist 8.17891 5.23634 4.09934 5.22356 6.95902 6.91318 8.38865 5.92529 7.3164 5.4694 numMergedOcc 0
20 mol 227 unq 2 iso 0 dist 6.95902 6.91318 4.09934 5.22356 8.17891 5.23634 5.4694 5.92529 7.3164 8.38865 numMergedOcc 0
21 mol 234 unq 0 iso 0 dist 9.39181 5.64285 6.45373 10.2693 10.475 7.81215 15.2927 14.5779 11.0592 7.5366 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 6.55759 9.12776 15.4844 15.7907 21.3432 9.72188 17.2012 21.2936 13.0611 7.32982 numMergedOcc 0
23 mol 238 unq 1 iso 0 dist 7.02475 9.12776 13.037 15.7907 17.436 9.72188 17.2012 15.7702 13.0611 7.32982 numMergedOcc 0
24 mol 238 unq 2 iso 0 dist 7.67322 9.12776 9.75095 15.7907 12.1104 9.72188 17.2012 10.6355 13.0611 7.32982 numMergedOcc 0
25 mol 238 unq 3 iso 0 dist 7.19008 9.12776 6.12722 15.7907 15.0465 9.72188 17.2012 16.1577 13.0611 7.32982 numMergedOcc 0
26 mol 259 unq 0 iso 0 dist 6.77938 6.9899 9.2872 9.98105 14.5785 5.85442 8.59697 12.1218 7.32929 8.55558 numMergedOcc 0
27 mol 259 unq 1 iso 0 dist 7.76676 6.9899 4.61451 9.98105 10.4634 5.85442 8.59697 9.22203 7.32929 8.55558 numMergedOcc 0
28 mol 277 unq 0 iso 0 dist 9.41725 8.9682 18.3854 11.8268 19.0768 9.57499 12.7237 16.6989 14.6871 6.57903 numMergedOcc 0
