0 mol 59 unq 0 iso 0 dist 6.5121 7.40411 11.1307 12.7672 18.0239 8.24062 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 7.24945 7.4804 5.26206 5.95491 9.81129 6.21982 numMergedOcc 0
2 mol 88 unq 0 iso 0 dist 7.69704 6.89004 6.07226 5.03121 11.8749 8.66514 numMergedOcc 0
3 mol 88 unq 1 iso 0 dist 7.69704 6.89004 6.07226 8.83682 14.2341 9.25235 numMergedOcc 0
4 mol 115 unq 0 iso 0 dist 6.60101 5.05103 5.81666 6.85928 12.0121 6.87861 numMergedOcc 0
5 mol 115 unq 1 iso 0 dist 8.83712 5.05103 5.56084 6.85928 5.60716 6.87861 numMergedOcc 0
6 mol 115 unq 2 iso 0 dist 6.60885 5.05103 6.98664 6.85928 5.52706 6.87861 numMergedOcc 0
7 mol 147 unq 0 iso 0 dist 8.64606 5.7191 5.90364 6.49634 5.96285 8.33261 numMergedOcc 0
8 mol 175 unq 0 iso 0 dist 7.72575 6.94119 12.1089 6.083 6.84347 9.31887 numMergedOcc 0
9 mol 194 unq 0 iso 0 dist 8.78345 8.73695 5.03763 6.97669 5.40592 6.47873 numMergedOcc 0
10 mol 265 unq 0 iso 0 dist 8.73109 7.27446 15.4199 4.86651 13.1262 6.34034 numMergedOcc 0
11 mol 265 unq 1 iso 0 dist 7.43195 7.27446 5.11366 4.86651 9.01586 6.34034 numMergedOcc 0
12 mol 272 unq 0 iso 0 dist 9.81981 9.32985 5.96981 10.8918 12.5113 6.73206 numMergedOcc 0
13 mol 272 unq 1 iso 0 dist 7.49228 5.50002 5.43733 12.6367 12.8442 9.09992 numMergedOcc 0
14 mol 272 unq 2 iso 0 dist 7.49228 5.50002 5.43733 5.85512 11.1067 6.16449 numMergedOcc 0
15 mol 278 unq 0 iso 0 dist 9.81682 8.8437 9.40662 5.89087 7.76881 6.35287 numMergedOcc 0
16 mol 282 unq 0 iso 0 dist 7.66682 8.99319 5.43514 6.1743 5.2527 8.3411 numMergedOcc 0
17 mol 293 unq 0 iso 0 dist 9.98322 5.86457 5.13597 7.45834 13.3178 8.56847 numMergedOcc 0
