0 mol 26 unq 0 iso 0 dist 9.15677 15.7188 6.73162 14.4326 7.47201 7.38466 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.61029 7.95969 6.73162 12.7979 7.47201 7.38466 numMergedOcc 0
2 mol 52 unq 0 iso 0 dist 7.68916 10.6328 7.18176 9.33879 5.75761 8.12937 numMergedOcc 0
3 mol 52 unq 1 iso 0 dist 7.47417 10.4155 7.18176 4.84074 5.75761 8.12937 numMergedOcc 0
4 mol 86 unq 0 iso 0 dist 7.26032 11.9674 7.79359 8.38738 6.81209 7.20037 numMergedOcc 0
5 mol 86 unq 1 iso 0 dist 5.49793 4.51657 7.79359 5.711 6.81209 7.20037 numMergedOcc 0
6 mol 117 unq 0 iso 0 dist 9.41387 6.69306 6.62561 6.65593 8.2236 6.37061 numMergedOcc 0
7 mol 127 unq 0 iso 0 dist 9.79448 11.8721 8.59981 7.91659 5.72373 4.98036 numMergedOcc 0
8 mol 127 unq 1 iso 0 dist 9.79448 11.5439 7.34519 7.91659 5.72373 8.57565 numMergedOcc 0
9 mol 132 unq 0 iso 0 dist 9.0339 9.29705 6.03703 7.17978 7.19937 6.73645 numMergedOcc 0
10 mol 175 unq 0 iso 0 dist 8.50904 14.6248 9.31887 6.08032 5.08591 9.19032 numMergedOcc 0
11 mol 175 unq 1 iso 0 dist 7.04318 6.61225 9.0664 6.08032 8.03727 7.15144 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 7.36642 7.13867 9.19704 9.59093 6.52987 11.6274 numMergedOcc 0
13 mol 213 unq 0 iso 0 dist 6.82185 10.693 6.0965 9.07848 8.29133 10.4683 numMergedOcc 0
14 mol 213 unq 1 iso 0 dist 6.82185 12.9129 9.59129 9.07848 8.29133 8.3461 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 8.49673 4.68558 7.20082 7.04661 6.09177 9.2906 numMergedOcc 0
16 mol 239 unq 1 iso 0 dist 8.49673 4.68558 7.20082 4.72616 7.18198 4.76769 numMergedOcc 0
17 mol 284 unq 0 iso 0 dist 7.18433 6.04378 4.86729 5.43038 8.06073 6.36552 numMergedOcc 0
