0 mol 28 unq 0 iso 0 dist 4.49593 5.66714 8.95154 6.69917 6.37119 7.28416 numMergedOcc 0
1 mol 92 unq 0 iso 0 dist 6.51132 5.41023 8.85601 8.99661 13.129 6.61823 numMergedOcc 0
2 mol 92 unq 1 iso 0 dist 6.51132 5.41023 8.85601 11.5285 12.8901 6.49956 numMergedOcc 0
3 mol 112 unq 0 iso 0 dist 7.87345 10.3209 6.87434 6.55773 4.25001 6.43433 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 9.11123 6.46673 7.60162 12.327 9.53672 6.98934 numMergedOcc 0
5 mol 119 unq 1 iso 0 dist 9.11123 6.46673 7.60162 13.9269 8.90156 7.99623 numMergedOcc 0
6 mol 143 unq 0 iso 0 dist 8.72521 16.1153 8.99891 10.4723 7.87644 8.41611 numMergedOcc 0
7 mol 143 unq 1 iso 0 dist 8.72521 16.1153 8.99891 18.3968 13.5899 7.63338 numMergedOcc 0
8 mol 143 unq 2 iso 0 dist 8.72521 16.1153 8.99891 16.801 9.13604 9.03707 numMergedOcc 0
9 mol 143 unq 3 iso 0 dist 8.72521 16.1153 8.99891 19.7069 12.6218 7.25673 numMergedOcc 0
10 mol 167 unq 0 iso 0 dist 8.87575 6.7811 9.86868 8.28222 3.67696 9.94125 numMergedOcc 0
11 mol 194 unq 0 iso 0 dist 9.06347 13.8911 9.52922 15.7489 7.82899 6.26839 numMergedOcc 0
12 mol 214 unq 0 iso 0 dist 9.71467 7.8151 9.06459 16.1653 13.3401 8.46327 numMergedOcc 0
13 mol 214 unq 1 iso 0 dist 6.03628 6.23589 9.06459 13.0019 13.3401 8.46327 numMergedOcc 0
14 mol 253 unq 0 iso 0 dist 9.2549 9.58656 8.94786 11.9188 3.15936 9.66465 numMergedOcc 0
15 mol 253 unq 1 iso 0 dist 8.86676 9.39286 9.27311 19.0469 16.4545 9.66465 numMergedOcc 0
16 mol 257 unq 0 iso 0 dist 8.18447 10.9917 9.6834 14.5333 8.52912 9.95546 numMergedOcc 0
17 mol 278 unq 0 iso 0 dist 9.24462 9.61803 5.35705 6.06813 5.78276 7.67245 numMergedOcc 0
18 mol 278 unq 1 iso 0 dist 9.24462 7.87608 6.64378 6.06813 5.78276 9.12395 numMergedOcc 0
19 mol 278 unq 2 iso 0 dist 6.01365 5.81569 5.35705 11.1517 5.78276 7.67245 numMergedOcc 0
20 mol 278 unq 3 iso 0 dist 6.01365 5.53924 6.64378 11.1517 5.78276 9.12395 numMergedOcc 0
