0 mol 7 unq 0 iso 0 dist 9.8603 14.6665 7.10621 20.1827 10.515 9.36807 19.4516 10.5461 13.2247 6.36911 16.2118 7.12508 6.1206 7.92429 9.87885 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.51421 10.6104 8.41585 10.9688 6.06176 6.36911 15.637 12.2333 13.2247 9.36807 16.4746 12.8323 9.87885 7.92429 6.1206 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 5.51421 10.6104 8.41585 10.9688 6.06176 6.36911 15.637 12.2333 13.2247 9.36807 20.7518 16.5681 14.1836 11.2233 7.67927 numMergedOcc 0
3 mol 16 unq 0 iso 0 dist 6.36377 4.78943 5.05803 9.05346 6.2983 7.03948 5.48395 6.31718 6.92781 5.47769 9.8871 4.65873 6.57331 4.68733 8.43054 numMergedOcc 0
4 mol 16 unq 1 iso 0 dist 6.36377 5.48395 6.31718 9.05346 6.2983 5.47769 4.78943 5.05803 6.92781 7.03948 9.30877 5.01101 11.0298 9.87867 6.42835 numMergedOcc 0
5 mol 16 unq 2 iso 0 dist 6.36377 5.48395 6.31718 9.05346 6.2983 5.47769 4.78943 5.05803 6.92781 7.03948 9.8871 4.65873 8.43054 4.68733 6.57331 numMergedOcc 0
6 mol 45 unq 0 iso 0 dist 7.19021 4.18584 6.43774 9.61766 4.71384 7.06308 9.0702 7.2846 5.24762 6.34173 13.4674 6.42339 11.5679 6.00679 9.33906 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 9.35868 8.25001 7.30858 15.8125 11.3902 8.66155 11.4509 13.8473 7.69052 9.66954 16.2777 15.3161 9.42082 6.49835 6.39384 numMergedOcc 0
8 mol 115 unq 1 iso 0 dist 4.98864 6.59772 6.11741 9.44544 4.61908 9.66954 10.9437 7.88312 7.69052 8.66155 16.4805 11.835 13.4105 9.13361 7.69765 numMergedOcc 0
9 mol 115 unq 2 iso 0 dist 4.98864 6.59772 6.11741 9.44544 4.61908 9.66954 10.9437 7.88312 7.69052 8.66155 9.47795 6.07067 6.39384 6.49835 9.42082 numMergedOcc 0
10 mol 115 unq 3 iso 0 dist 4.98864 10.9437 7.88312 9.44544 4.61908 8.66155 6.59772 6.11741 7.69052 9.66954 9.47795 6.07067 9.42082 6.49835 6.39384 numMergedOcc 0
11 mol 115 unq 4 iso 0 dist 7.95871 4.86477 6.11741 12.2966 4.61908 9.66954 12.0354 7.88312 7.69052 8.66155 17.9091 11.835 13.4105 9.13361 7.69765 numMergedOcc 0
12 mol 115 unq 5 iso 0 dist 7.95871 4.86477 6.11741 12.2966 4.61908 9.66954 12.0354 7.88312 7.69052 8.66155 9.29473 6.07067 6.39384 6.49835 9.42082 numMergedOcc 0
13 mol 115 unq 6 iso 0 dist 7.95871 12.0354 7.88312 12.2966 4.61908 8.66155 4.86477 6.11741 7.69052 9.66954 9.29473 6.07067 9.42082 6.49835 6.39384 numMergedOcc 0
14 mol 117 unq 0 iso 0 dist 6.90827 10.4485 7.90328 9.58171 4.91401 6.62561 5.27151 7.83136 7.22206 7.63616 6.78655 3.55765 10.4223 5.56883 8.19331 numMergedOcc 0
15 mol 117 unq 1 iso 0 dist 6.90827 5.27151 7.83136 9.58171 4.91401 7.63616 10.4485 7.90328 7.22206 6.62561 15.0886 10.5783 11.6387 6.95589 6.10127 numMergedOcc 0
16 mol 117 unq 2 iso 0 dist 8.90977 13.8755 7.90328 13.2996 4.91401 6.62561 10.6616 7.83136 7.22206 7.63616 9.42037 3.55765 10.4223 5.56883 8.19331 numMergedOcc 0
17 mol 117 unq 3 iso 0 dist 8.90977 10.6616 7.83136 13.2996 4.91401 7.63616 13.8755 7.90328 7.22206 6.62561 18.6425 10.5783 11.6387 6.95589 6.10127 numMergedOcc 0
18 mol 127 unq 0 iso 0 dist 9.42513 8.60326 9.30299 13.306 13.1312 7.34519 11.4002 14.9565 6.16471 6.63981 14.7894 17.5098 11.5667 6.15949 7.79505 numMergedOcc 0
19 mol 132 unq 0 iso 0 dist 8.7366 4.90475 7.7059 10.9124 9.92344 6.03703 6.34266 11.5751 4.35917 7.61505 10.6383 12.9631 6.89918 6.545 7.89457 numMergedOcc 0
20 mol 224 unq 0 iso 0 dist 8.39002 9.98893 8.95269 11.3096 5.29877 6.67585 5.72088 6.57273 4.70378 6.65984 6.32334 7.05804 13.2325 10.9705 8.79428 numMergedOcc 0
21 mol 227 unq 0 iso 0 dist 9.07872 9.9474 7.09863 16.431 9.13836 8.17891 14.0536 10.8157 5.22356 6.95902 13.0848 5.83175 5.23634 4.09934 6.91318 numMergedOcc 0
22 mol 235 unq 0 iso 0 dist 8.48065 5.23741 5.4638 14.8164 9.66021 9.58736 21.6511 15.3051 16.4493 6.98084 16.0384 11.7928 11.0129 4.47008 8.19317 numMergedOcc 0
23 mol 235 unq 1 iso 0 dist 8.48065 5.23741 5.4638 14.8164 9.66021 9.58736 21.6511 15.3051 16.4493 6.98084 20.2239 14.5867 15.1974 7.34601 6.29377 numMergedOcc 0
24 mol 235 unq 2 iso 0 dist 8.48065 5.23741 5.4638 14.8164 9.66021 9.58736 20.4398 16.4776 15.4 7.32211 16.0384 11.7928 11.0129 4.47008 5.1823 numMergedOcc 0
25 mol 235 unq 3 iso 0 dist 8.48065 5.23741 5.4638 14.8164 9.66021 9.58736 20.4398 16.4776 15.4 7.32211 20.2239 14.5867 15.1974 7.34601 5.70635 numMergedOcc 0
26 mol 236 unq 0 iso 0 dist 9.89665 4.38595 6.84306 10.3034 11.3552 7.17676 11.247 7.68742 7.28249 5.34718 13.747 4.89609 10.1317 13.0765 9.3206 numMergedOcc 0
27 mol 236 unq 1 iso 0 dist 9.05929 4.38595 8.35971 10.3034 6.40312 7.17676 11.247 11.2141 7.28249 5.34718 13.747 16.9105 10.1317 13.0765 9.3206 numMergedOcc 0
28 mol 236 unq 2 iso 0 dist 5.66569 11.2013 9.99038 6.98151 6.04825 7.17676 4.15973 6.27581 7.28249 5.34718 11.2893 10.5774 10.1317 13.0765 9.3206 numMergedOcc 0
29 mol 236 unq 3 iso 0 dist 6.11137 15.1664 9.99038 9.91572 6.04825 7.17676 9.01197 6.27581 7.28249 5.34718 14.0625 10.5774 10.1317 13.0765 9.3206 numMergedOcc 0
30 mol 238 unq 0 iso 0 dist 6.24928 5.33567 6.57393 8.81534 6.20606 5.38637 9.85437 11.101 5.42006 6.55759 17.4614 20.1157 13.9551 15.4844 9.12776 numMergedOcc 0
31 mol 238 unq 1 iso 0 dist 9.94315 12.521 5.72887 12.9182 13.069 9.29858 16.7396 12.8711 10.1648 9.68513 18.4917 17.2864 12.7605 5.99163 8.82351 numMergedOcc 0
32 mol 238 unq 2 iso 0 dist 8.59074 9.18011 5.72887 9.77231 13.069 9.29858 15.3161 12.8711 10.1648 9.68513 15.6667 17.2864 12.7605 5.99163 8.82351 numMergedOcc 0
33 mol 238 unq 3 iso 0 dist 6.2365 4.7157 5.72887 10.2583 13.069 9.29858 14.1709 12.8711 10.1648 9.68513 15.1318 17.2864 12.7605 5.99163 8.82351 numMergedOcc 0
34 mol 259 unq 0 iso 0 dist 6.42725 8.70769 5.30224 8.65525 5.31048 8.37865 15.0854 12.0576 12.5353 7.48005 13.9782 14.6375 17.0253 9.98303 9.63573 numMergedOcc 0
35 mol 259 unq 1 iso 0 dist 6.42725 8.70769 5.30224 8.65525 5.31048 8.37865 15.0854 12.0576 12.5353 7.48005 21.3106 19.2084 20.1127 14.0829 7.66153 numMergedOcc 0
