0 mol 21 unq 0 iso 0 dist 8.38921 6.86154 6.08338 5.20061 5.93898 4.28381 10.5369 10.6971 6.93185 6.28263 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 7.63534 6.55474 8.19682 10.4541 9.85905 4.00608 9.2958 6.45686 7.03226 7.46095 numMergedOcc 0
2 mol 76 unq 1 iso 0 dist 8.51543 8.36307 6.21982 5.4968 6.72869 4.00608 11.2779 4.85247 7.03226 7.46095 numMergedOcc 0
3 mol 115 unq 0 iso 0 dist 5.11612 5.39389 7.76729 3.85674 6.24825 5.78043 12.9167 14.0688 7.70313 11.7584 numMergedOcc 0
4 mol 115 unq 1 iso 0 dist 5.22628 5.26498 7.64585 3.82475 6.39384 5.65471 9.19273 6.40494 7.52142 10.2171 numMergedOcc 0
5 mol 134 unq 0 iso 0 dist 8.75736 9.88404 8.94837 14.0091 9.00918 5.58312 15.5174 14.2198 6.93279 7.83568 numMergedOcc 0
6 mol 134 unq 1 iso 0 dist 8.75736 9.88404 8.94837 15.5753 7.99477 9.61537 15.5174 14.2198 6.93279 12.0743 numMergedOcc 0
7 mol 134 unq 2 iso 0 dist 6.76166 6.15672 8.94837 9.88169 9.00918 5.58312 12.8792 14.2198 6.93279 7.83568 numMergedOcc 0
8 mol 134 unq 3 iso 0 dist 6.76166 6.15672 8.94837 11.8593 7.99477 9.61537 12.8792 14.2198 6.93279 12.0743 numMergedOcc 0
9 mol 192 unq 0 iso 0 dist 6.44896 6.15396 8.36822 4.77116 9.78634 10.3099 11.3948 8.49529 7.33225 15.7529 numMergedOcc 0
10 mol 192 unq 1 iso 0 dist 6.44896 6.15396 8.36822 4.65378 5.64942 10.1087 11.3948 8.49529 7.33225 13.3256 numMergedOcc 0
11 mol 192 unq 2 iso 0 dist 6.44896 6.15396 8.36822 5.48435 7.43054 10.0566 11.3948 8.49529 7.33225 13.7172 numMergedOcc 0
12 mol 234 unq 0 iso 0 dist 8.9413 6.40261 9.5707 14.075 7.81215 11.8229 12.7701 10.0059 7.43663 7.77911 numMergedOcc 0
13 mol 234 unq 1 iso 0 dist 4.91961 12.2893 9.5707 4.84686 7.81215 11.8229 9.33455 10.0059 7.43663 7.77911 numMergedOcc 0
14 mol 234 unq 2 iso 0 dist 7.14333 10.3017 9.39181 4.84686 5.64285 6.45373 9.33455 5.08515 7.94068 7.77911 numMergedOcc 0
15 mol 234 unq 3 iso 0 dist 7.14333 10.3017 9.39181 4.84686 5.64285 6.45373 16.0559 12.6661 7.22019 12.6164 numMergedOcc 0
16 mol 235 unq 0 iso 0 dist 8.79626 12.9417 7.32211 9.92254 5.1823 4.47008 14.0786 6.46722 7.31773 8.97952 numMergedOcc 0
17 mol 235 unq 1 iso 0 dist 8.79626 12.9417 7.32211 5.66713 5.70635 7.34601 14.0786 6.46722 7.31773 10.1845 numMergedOcc 0
18 mol 241 unq 0 iso 0 dist 6.97756 8.28913 6.83797 4.63415 7.95042 12.0248 9.36895 4.90279 8.00537 10.8022 numMergedOcc 0
19 mol 259 unq 0 iso 0 dist 6.20344 12.9748 7.48005 10.4532 9.63573 9.98303 10.7258 8.81835 8.71497 11.547 numMergedOcc 0
20 mol 259 unq 1 iso 0 dist 6.20344 12.9748 7.48005 5.13757 7.66153 14.0829 10.7258 8.81835 8.71497 14.6679 numMergedOcc 0
21 mol 284 unq 0 iso 0 dist 9.12551 10.7029 4.86729 3.97057 5.83329 7.67245 13.1896 4.50325 6.61376 10.2645 numMergedOcc 0
