0 mol 7 unq 0 iso 0 dist 9.8603 9.33944 6.22805 14.6665 7.10621 6.96396 20.1368 10.789 13.6699 7.31201 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.8603 9.33944 6.22805 14.6665 7.10621 6.96396 20.1827 10.515 13.3157 9.36807 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 8.05508 6.07398 9.05547 5.34079 6.85766 6.34748 11.5407 7.29033 10.5678 6.71911 numMergedOcc 0
3 mol 115 unq 0 iso 0 dist 9.35868 5.58465 7.44784 8.25001 7.30858 7.64822 15.8125 11.3902 12.3154 8.66155 numMergedOcc 0
4 mol 115 unq 1 iso 0 dist 4.98864 9.35695 9.56867 6.59772 6.11741 9.97256 9.44544 4.61908 12.3154 9.66954 numMergedOcc 0
5 mol 115 unq 2 iso 0 dist 4.98864 9.35695 9.56867 6.59772 6.11741 9.97256 12.7883 10.8939 17.2085 7.64585 numMergedOcc 0
6 mol 115 unq 3 iso 0 dist 4.98864 9.35695 9.56867 10.9437 7.88312 7.64822 9.44544 4.61908 12.3154 8.66155 numMergedOcc 0
7 mol 115 unq 4 iso 0 dist 7.95871 11.703 9.56867 4.86477 6.11741 9.97256 12.2966 4.61908 12.3154 9.66954 numMergedOcc 0
8 mol 115 unq 5 iso 0 dist 7.95871 11.703 9.56867 4.86477 6.11741 9.97256 10.1292 10.8939 17.2085 7.64585 numMergedOcc 0
9 mol 115 unq 6 iso 0 dist 7.95871 11.703 9.56867 12.0354 7.88312 7.64822 12.2966 4.61908 12.3154 8.66155 numMergedOcc 0
10 mol 127 unq 0 iso 0 dist 9.42513 4.42983 7.73139 8.60326 9.30299 11.0785 16.2351 14.085 17.6467 8.59981 numMergedOcc 0
11 mol 127 unq 1 iso 0 dist 9.42513 4.42983 7.73139 8.60326 9.30299 11.0785 13.306 13.1312 16.0863 7.34519 numMergedOcc 0
12 mol 127 unq 2 iso 0 dist 9.42513 9.88569 6.66607 8.60326 9.30299 8.89539 16.2351 14.085 10.9741 8.59981 numMergedOcc 0
13 mol 127 unq 3 iso 0 dist 9.42513 9.88569 6.66607 8.60326 9.30299 8.89539 13.306 13.1312 15.4483 7.34519 numMergedOcc 0
14 mol 127 unq 4 iso 0 dist 9.42513 5.88232 8.62711 8.60326 9.30299 10.345 16.2351 14.085 18.5156 8.59981 numMergedOcc 0
15 mol 127 unq 5 iso 0 dist 9.42513 5.88232 8.62711 8.60326 9.30299 10.345 13.306 13.1312 11.9686 7.34519 numMergedOcc 0
16 mol 155 unq 0 iso 0 dist 6.7973 6.12669 7.28355 5.01118 6.23493 4.8645 9.16944 4.9093 11.7713 9.17284 numMergedOcc 0
17 mol 167 unq 0 iso 0 dist 5.59806 5.30254 7.83781 8.66436 9.87651 6.43506 9.19849 6.58937 11.0314 8.62646 numMergedOcc 0
18 mol 214 unq 0 iso 0 dist 9.51764 18.2005 9.40003 6.53326 8.85478 16.922 11.3587 6.67959 13.7287 7.46831 numMergedOcc 0
19 mol 214 unq 1 iso 0 dist 9.51764 4.74203 8.68385 6.53326 8.85478 9.18071 11.3587 6.67959 10.7631 7.46831 numMergedOcc 0
20 mol 214 unq 2 iso 0 dist 5.36829 4.87713 9.40003 12.3481 8.85478 16.922 10.5513 6.67959 13.7287 7.46831 numMergedOcc 0
21 mol 214 unq 3 iso 0 dist 5.36829 13.4762 8.68385 12.3481 8.85478 9.18071 10.5513 6.67959 10.7631 7.46831 numMergedOcc 0
22 mol 236 unq 0 iso 0 dist 9.05929 6.0905 6.73134 4.38595 8.35971 5.27568 10.3034 6.40312 5.77356 7.17676 numMergedOcc 0
23 mol 236 unq 1 iso 0 dist 9.05929 6.0905 6.73134 4.38595 8.35971 5.27568 8.71945 6.2568 9.24309 6.68463 numMergedOcc 0
24 mol 238 unq 0 iso 0 dist 9.94315 15.8036 7.98022 12.521 5.72887 6.3873 12.9182 13.069 14.7533 9.29858 numMergedOcc 0
25 mol 238 unq 1 iso 0 dist 8.59074 12.1988 7.98022 9.18011 5.72887 6.3873 9.77231 13.069 14.7533 9.29858 numMergedOcc 0
26 mol 238 unq 2 iso 0 dist 6.2365 6.12122 7.98022 4.7157 5.72887 6.3873 10.2583 13.069 14.7533 9.29858 numMergedOcc 0
27 mol 259 unq 0 iso 0 dist 8.06771 5.73217 6.96379 9.79538 7.88519 12.7595 13.1236 11.6195 15.1733 7.48005 numMergedOcc 0
28 mol 261 unq 0 iso 0 dist 9.73983 11.7215 8.50313 4.49913 8.45658 13.3163 10.4678 5.22253 13.5663 7.47164 numMergedOcc 0
29 mol 261 unq 1 iso 0 dist 9.73983 13.4973 7.6414 4.49913 8.45658 13.6041 10.4678 5.22253 12.6505 7.47164 numMergedOcc 0
