0 mol 32 unq 0 iso 0 dist 7.03411 4.28227 4.95327 12.7423 6.4024 9.17591 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 9.37127 10.2246 9.52298 13.9322 9.5489 7.12259 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 8.87326 8.24627 5.48997 15.0752 6.94076 8.06263 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 5.99047 9.16318 5.48997 12.7193 6.94076 8.06263 numMergedOcc 0
4 mol 71 unq 0 iso 0 dist 8.59923 5.10388 7.12853 9.05218 5.01302 4.87423 numMergedOcc 0
5 mol 71 unq 1 iso 0 dist 8.59923 5.10388 7.12853 9.95424 9.08204 7.75237 numMergedOcc 0
6 mol 71 unq 2 iso 0 dist 8.59923 5.82845 6.14513 9.05218 5.01302 4.76283 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 8.70465 8.54022 6.85356 8.27446 4.63063 7.02351 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 8.70465 15.6804 7.32265 12.9325 8.30433 7.53504 numMergedOcc 0
9 mol 73 unq 2 iso 0 dist 8.70465 15.6804 7.32265 8.27446 4.63063 8.66342 numMergedOcc 0
10 mol 73 unq 3 iso 0 dist 8.70465 15.6804 7.32265 9.76332 4.68175 7.21285 numMergedOcc 0
11 mol 73 unq 4 iso 0 dist 8.70465 15.6804 7.32265 16.6864 10.0459 6.95094 numMergedOcc 0
12 mol 105 unq 0 iso 0 dist 6.37212 11.0792 9.96269 12.6106 8.60755 9.87685 numMergedOcc 0
13 mol 124 unq 0 iso 0 dist 6.31955 5.87352 8.03603 8.25764 5.26643 5.61764 numMergedOcc 0
14 mol 156 unq 0 iso 0 dist 8.95171 13.2289 5.50879 8.66164 4.68339 6.47989 numMergedOcc 0
15 mol 174 unq 0 iso 0 dist 7.95194 9.20084 8.15275 12.8342 5.46023 8.67807 numMergedOcc 0
16 mol 209 unq 0 iso 0 dist 8.9906 13.8836 8.8886 15.6748 8.13817 7.757 numMergedOcc 0
17 mol 209 unq 1 iso 0 dist 8.9906 15.5731 8.78565 15.6748 8.13817 9.56015 numMergedOcc 0
18 mol 210 unq 0 iso 0 dist 9.30279 6.5876 8.94889 14.086 12.3142 7.68078 numMergedOcc 0
19 mol 210 unq 1 iso 0 dist 9.30279 6.5876 8.94889 10.3522 13.7365 9.26518 numMergedOcc 0
20 mol 260 unq 0 iso 0 dist 8.88803 5.14726 8.13605 4.1077 11.3568 9.05149 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 4.66834 5.57184 6.40125 7.64708 6.08499 8.83777 numMergedOcc 0
22 mol 277 unq 1 iso 0 dist 4.66834 5.57184 6.40125 5.73065 10.3278 9.42812 numMergedOcc 0
23 mol 280 unq 0 iso 0 dist 8.45851 11.5456 6.38295 20.471 14.0927 9.047 numMergedOcc 0
24 mol 280 unq 1 iso 0 dist 8.45851 11.5456 6.38295 15.5931 11.4101 9.9227 numMergedOcc 0
