0 mol 11 unq 0 iso 0 dist 5.7435 11.1513 9.53002 11.4417 10.9183 8.73067 13.4066 10.7048 4.79838 6.76736 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 9.59244 4.07863 6.23899 7.69638 11.1914 9.43355 4.90216 11.6713 7.92479 3.68327 numMergedOcc 0
2 mol 59 unq 1 iso 0 dist 9.59244 4.07863 6.23899 7.69638 11.1914 9.43355 9.84217 3.88148 7.86646 9.13939 numMergedOcc 0
3 mol 59 unq 2 iso 0 dist 9.59244 4.07863 6.23899 11.9788 6.435 7.9327 4.90216 11.6713 7.92479 15.3578 numMergedOcc 0
4 mol 59 unq 3 iso 0 dist 9.59244 4.07863 6.23899 11.9788 6.435 7.9327 9.84217 3.88148 7.86646 10.3023 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 8.2377 12.6436 5.64598 16.651 8.44406 7.10439 10.0651 3.85805 7.78587 7.98468 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 6.18305 4.31731 4.65521 9.54477 6.56633 7.10439 10.869 5.17781 7.78587 7.98468 numMergedOcc 0
7 mol 90 unq 0 iso 0 dist 9.44078 9.76996 8.39016 15.4206 9.60325 9.56752 10.177 4.79453 6.18681 5.57394 numMergedOcc 0
8 mol 90 unq 1 iso 0 dist 9.44078 9.76996 8.39016 15.4206 9.60325 9.56752 15.1616 7.5298 9.33288 3.54647 numMergedOcc 0
9 mol 90 unq 2 iso 0 dist 5.9179 4.97513 8.39016 11.4116 9.60325 9.56752 6.10053 4.79453 6.18681 5.57394 numMergedOcc 0
10 mol 90 unq 3 iso 0 dist 5.9179 4.97513 8.39016 11.4116 9.60325 9.56752 10.6805 7.5298 9.33288 3.54647 numMergedOcc 0
11 mol 90 unq 4 iso 0 dist 9.34782 4.97513 6.99355 11.4116 7.25602 9.56752 6.10053 6.34112 6.18681 5.57394 numMergedOcc 0
12 mol 90 unq 5 iso 0 dist 9.34782 4.97513 6.99355 11.4116 7.25602 9.56752 10.6805 4.87139 9.33288 3.54647 numMergedOcc 0
13 mol 232 unq 0 iso 0 dist 7.70279 6.17401 7.07392 9.41148 6.2188 7.10413 9.67243 4.14873 8.49913 9.85068 numMergedOcc 0
14 mol 234 unq 0 iso 0 dist 7.86368 16.9465 9.5707 14.6064 10.0059 7.43663 19.2408 12.7879 5.69634 6.67757 numMergedOcc 0
15 mol 235 unq 0 iso 0 dist 8.48065 5.52698 8.21247 10.8785 7.60081 7.95766 8.1174 4.75609 9.11149 6.82702 numMergedOcc 0
16 mol 256 unq 0 iso 0 dist 7.67598 9.40096 5.24676 10.2924 5.28793 7.48269 13.3942 6.73995 5.85613 5.59732 numMergedOcc 0
17 mol 256 unq 1 iso 0 dist 7.67598 9.40096 5.24676 12.6443 4.99672 6.71249 13.3942 6.73995 5.85613 3.96807 numMergedOcc 0
18 mol 256 unq 2 iso 0 dist 7.67598 9.40096 5.24676 12.4604 7.7384 9.18903 13.3942 6.73995 5.85613 11.141 numMergedOcc 0
19 mol 259 unq 0 iso 0 dist 9.12507 4.09442 8.37865 8.90398 8.75685 8.71497 12.7634 9.53031 9.28024 9.75001 numMergedOcc 0
20 mol 264 unq 0 iso 0 dist 8.43858 15.8008 9.5784 13.7665 7.52936 7.34094 18.2223 11.147 8.56867 13.0664 numMergedOcc 0
21 mol 264 unq 1 iso 0 dist 8.43858 15.8008 9.5784 13.7665 7.52936 7.34094 17.6227 10.0018 6.29872 10.4666 numMergedOcc 0
22 mol 274 unq 0 iso 0 dist 6.55855 5.95459 9.19234 6.83113 5.64601 9.20749 9.82713 4.60007 9.85661 6.97575 numMergedOcc 0
