0 mol 73 unq 0 iso 0 dist 8.70133 7.04044 11.2505 9.73086 6.15714 7.8972 5.4148 4.65521 8.73253 7.4369 numMergedOcc 0
1 mol 73 unq 1 iso 0 dist 4.65521 8.73253 11.2505 7.4369 6.15714 7.8972 5.4148 8.70133 7.04044 9.73086 numMergedOcc 0
2 mol 73 unq 2 iso 0 dist 7.13087 5.16364 5.69513 5.61588 8.97361 5.50891 8.07446 13.6145 8.85586 5.5087 numMergedOcc 0
3 mol 73 unq 3 iso 0 dist 7.13087 5.16364 5.69513 7.83244 10.2983 4.75954 8.07446 13.6145 8.85586 6.08682 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 8.97793 4.79949 6.81799 9.85905 9.21694 11.0792 10.2879 11.062 13.187 6.72869 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 8.97793 7.27693 6.42322 9.85905 9.21694 6.48293 10.2879 11.062 11.2278 6.72869 numMergedOcc 0
6 mol 76 unq 2 iso 0 dist 8.19682 4.79949 8.83525 9.85905 4.00608 11.0792 10.2879 6.21982 13.187 6.72869 numMergedOcc 0
7 mol 76 unq 3 iso 0 dist 8.19682 7.27693 5.77727 9.85905 4.00608 6.48293 10.2879 6.21982 11.2278 6.72869 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 8.66155 5.72642 5.87507 9.42082 6.49835 10.5109 7.69052 9.66954 10.9734 6.39384 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 8.79571 8.20836 9.65798 7.21868 5.67107 4.935 5.62899 13.0121 7.36779 9.66543 numMergedOcc 0
10 mol 134 unq 1 iso 0 dist 8.79571 8.20836 9.65798 7.21868 5.67107 4.935 5.49782 5.42582 10.873 7.93372 numMergedOcc 0
11 mol 142 unq 0 iso 0 dist 7.15475 9.17106 5.14959 7.81207 5.26247 9.38687 5.32922 9.07935 12.432 6.14151 numMergedOcc 0
12 mol 218 unq 0 iso 0 dist 8.53199 8.06216 5.31559 7.33709 11.6662 7.4492 4.72474 12.0819 11.565 8.75536 numMergedOcc 0
13 mol 218 unq 1 iso 0 dist 8.53199 8.06216 5.31559 7.33709 11.6662 7.4492 5.61978 13.6555 11.5105 6.67404 numMergedOcc 0
14 mol 218 unq 2 iso 0 dist 8.53199 5.76954 8.21424 7.33709 11.6662 6.57708 4.72474 12.0819 6.29367 8.75536 numMergedOcc 0
15 mol 218 unq 3 iso 0 dist 8.53199 5.76954 8.21424 7.33709 11.6662 6.57708 5.61978 13.6555 9.20961 6.67404 numMergedOcc 0
16 mol 218 unq 4 iso 0 dist 8.53199 6.29511 10.1198 7.33709 11.6662 13.4147 4.72474 12.0819 8.86175 8.75536 numMergedOcc 0
17 mol 218 unq 5 iso 0 dist 8.53199 6.29511 10.1198 7.33709 11.6662 13.4147 5.61978 13.6555 9.91544 6.67404 numMergedOcc 0
18 mol 227 unq 0 iso 0 dist 9.62609 5.4694 5.23507 6.91318 11.5454 7.3164 5.22356 13.4493 8.38865 5.23634 numMergedOcc 0
19 mol 227 unq 1 iso 0 dist 8.17891 8.38865 5.92529 5.23634 4.09934 7.3164 5.22356 6.95902 5.4694 6.91318 numMergedOcc 0
20 mol 227 unq 2 iso 0 dist 6.95902 5.4694 5.92529 6.91318 4.09934 7.3164 5.22356 8.17891 8.38865 5.23634 numMergedOcc 0
21 mol 234 unq 0 iso 0 dist 9.5707 7.5366 16.5499 7.81215 11.8229 11.0592 10.2693 11.8897 15.2927 5.64285 numMergedOcc 0
22 mol 234 unq 1 iso 0 dist 7.85175 7.5366 13.0974 7.81215 10.5304 11.0592 10.2693 13.0678 15.2927 5.64285 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 9.29858 7.32982 6.48619 9.72188 11.7938 13.0611 15.7907 12.3367 17.2012 9.12776 numMergedOcc 0
24 mol 257 unq 0 iso 0 dist 7.27505 9.69696 5.04668 7.81897 7.89807 5.96144 5.74182 10.9918 10.8431 6.34915 numMergedOcc 0
25 mol 259 unq 0 iso 0 dist 6.77938 8.59697 12.1218 6.9899 9.2872 7.32929 9.98105 14.5785 8.55558 5.85442 numMergedOcc 0
26 mol 259 unq 1 iso 0 dist 7.76676 8.59697 9.22203 6.9899 4.61451 7.32929 9.98105 10.4634 8.55558 5.85442 numMergedOcc 0
