0 mol 7 unq 0 iso 0 dist 5.77374 9.30196 6.0323 10.9529 5.96526 8.05125 19.4294 13.7851 14.326 9.02869 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 5.58346 10.362 7.53504 12.5369 8.30433 7.32265 18.8887 14.0106 14.1204 7.45777 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 9.10386 14.2654 7.02351 12.5369 4.63063 6.85356 18.8887 10.0291 10.345 7.45777 numMergedOcc 0
3 mol 73 unq 2 iso 0 dist 9.10386 10.362 8.66342 12.5369 4.63063 7.32265 18.8887 10.0291 14.1204 7.45777 numMergedOcc 0
4 mol 73 unq 3 iso 0 dist 9.78545 14.5223 6.95094 12.1521 10.0459 7.32265 9.70734 13.8777 14.1204 7.45777 numMergedOcc 0
5 mol 73 unq 4 iso 0 dist 9.97998 11.7502 6.95094 10.1371 10.0459 7.32265 9.93198 13.8777 14.1204 7.45777 numMergedOcc 0
6 mol 73 unq 5 iso 0 dist 9.66744 4.5646 7.53504 10.3418 8.30433 7.32265 17.6545 14.0106 14.1204 7.45777 numMergedOcc 0
7 mol 90 unq 0 iso 0 dist 9.28585 10.156 8.6308 13.0735 5.12529 7.94379 4.59148 6.6146 6.3566 9.06641 numMergedOcc 0
8 mol 99 unq 0 iso 0 dist 5.33644 5.36117 8.23566 5.61946 4.74328 4.82346 6.02095 6.81741 8.61334 8.68674 numMergedOcc 0
9 mol 124 unq 0 iso 0 dist 7.83509 8.00585 5.61764 11.7109 5.26643 8.03603 15.8394 10.619 9.2094 7.18976 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 8.89412 10.3282 7.8034 16.1271 10.1774 6.45169 19.2422 15.3607 9.13134 6.08846 numMergedOcc 0
11 mol 131 unq 1 iso 0 dist 8.89412 10.3282 7.8034 16.1271 10.1774 6.45169 18.6924 16.1827 9.57821 9.19171 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 9.49104 12.0027 9.21999 15.9043 10.6104 6.00896 8.22726 5.33543 5.57607 9.88178 numMergedOcc 0
13 mol 183 unq 0 iso 0 dist 7.38821 8.72592 9.82833 11.0442 9.01399 9.84649 4.0252 7.69421 4.92164 8.97652 numMergedOcc 0
14 mol 192 unq 0 iso 0 dist 7.252 9.99333 7.72242 9.78743 5.21255 5.83093 13.2525 7.30965 6.16078 6.2016 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 9.32657 14.0402 8.21112 16.8743 8.82544 6.02053 18.871 12.9088 6.38518 5.86839 numMergedOcc 0
16 mol 205 unq 1 iso 0 dist 9.32657 11.0093 7.06533 16.8743 8.82544 7.41663 18.871 12.9088 7.86936 5.86839 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 8.68803 4.53635 8.01565 4.53228 5.94643 7.10828 10.9464 10.2589 13.8702 8.26312 numMergedOcc 0
18 mol 239 unq 1 iso 0 dist 8.68803 4.53635 8.01565 4.53228 5.94643 7.10828 6.54316 9.59937 8.46058 7.58554 numMergedOcc 0
19 mol 259 unq 0 iso 0 dist 9.30018 4.54952 5.96276 12.9294 7.53628 9.78704 8.76241 12.1069 8.46595 9.86267 numMergedOcc 0
