0 mol 71 unq 0 iso 0 dist 8.39608 6.82169 6.59302 10.3916 11.5433 8.47626 numMergedOcc 0
1 mol 71 unq 1 iso 0 dist 7.28815 10.5616 6.59302 17.7334 11.5433 8.47626 numMergedOcc 0
2 mol 94 unq 0 iso 0 dist 6.91081 4.4432 5.20598 11.5929 7.0184 7.38914 numMergedOcc 0
3 mol 94 unq 1 iso 0 dist 6.91081 4.4432 5.20598 10.2914 6.54023 7.0529 numMergedOcc 0
4 mol 99 unq 0 iso 0 dist 8.44207 11.0363 9.46619 13.7132 7.35957 6.6925 numMergedOcc 0
5 mol 99 unq 1 iso 0 dist 8.44207 11.0363 9.46619 12.8297 8.5606 7.12746 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 7.67877 11.1968 9.17877 13.0128 6.24842 9.05357 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 5.9962 11.4175 6.61636 16.3628 10.6348 9.94276 numMergedOcc 0
8 mol 133 unq 2 iso 0 dist 5.9962 11.4175 6.61636 10.6348 6.47676 9.05357 numMergedOcc 0
9 mol 133 unq 3 iso 0 dist 5.9962 11.4175 6.61636 12.713 6.95294 5.99299 numMergedOcc 0
10 mol 133 unq 4 iso 0 dist 8.61448 6.2062 6.61636 15.1748 10.6348 9.94276 numMergedOcc 0
11 mol 133 unq 5 iso 0 dist 8.61448 6.2062 6.61636 13.8795 6.47676 9.05357 numMergedOcc 0
12 mol 133 unq 6 iso 0 dist 8.61448 6.2062 6.61636 8.9344 6.95294 5.99299 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 9.28415 7.03121 7.82011 11.1454 6.55605 8.55681 numMergedOcc 0
14 mol 173 unq 0 iso 0 dist 6.7407 10.5012 7.33162 15.4477 14.5546 9.79554 numMergedOcc 0
15 mol 187 unq 0 iso 0 dist 5.82577 5.94354 7.9625 8.26654 8.43209 7.01496 numMergedOcc 0
16 mol 233 unq 0 iso 0 dist 6.87565 5.19341 5.64376 10.3183 5.19718 9.2911 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 9.29888 8.59287 6.40309 12.2552 11.7895 6.5772 numMergedOcc 0
18 mol 254 unq 0 iso 0 dist 9.91996 17.3639 9.84153 14.3881 5.86084 6.03988 numMergedOcc 0
19 mol 272 unq 0 iso 0 dist 7.38085 6.75411 6.52635 12.7472 8.27114 9.59519 numMergedOcc 0
20 mol 293 unq 0 iso 0 dist 6.97887 11.0749 7.2668 11.7191 9.52493 9.70656 numMergedOcc 0
21 mol 293 unq 1 iso 0 dist 6.97887 11.0749 7.2668 12.8198 9.50787 6.33356 numMergedOcc 0
22 mol 293 unq 2 iso 0 dist 6.04186 11.0749 8.88355 11.7191 6.17637 9.70656 numMergedOcc 0
23 mol 293 unq 3 iso 0 dist 6.04186 11.0749 8.88355 12.8198 7.77971 6.33356 numMergedOcc 0
