0 mol 10 unq 0 iso 0 dist 8.53436 7.48812 8.61887 3.26546 9.6581 9.00506 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 9.53901 6.78786 9.73924 4.14243 7.49423 9.42171 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.94312 6.45886 9.7596 12.3047 6.8173 9.67609 numMergedOcc 0
3 mol 88 unq 0 iso 0 dist 6.41105 5.38475 9.3278 6.65892 9.27633 6.50926 numMergedOcc 0
4 mol 88 unq 1 iso 0 dist 6.41105 5.38475 9.3278 4.55647 7.59715 9.85837 numMergedOcc 0
5 mol 101 unq 0 iso 0 dist 9.1109 8.67739 7.42633 4.80201 8.83779 4.97717 numMergedOcc 0
6 mol 165 unq 0 iso 0 dist 6.31455 5.0379 9.73305 3.67488 9.93641 4.0096 numMergedOcc 0
7 mol 176 unq 0 iso 0 dist 7.02608 7.31574 7.84713 11.5221 7.69241 8.99941 numMergedOcc 0
8 mol 176 unq 1 iso 0 dist 7.02608 7.31574 7.84713 5.5435 8.56192 10.5654 numMergedOcc 0
9 mol 176 unq 2 iso 0 dist 7.02608 7.31574 7.84713 10.9534 7.77962 5.05254 numMergedOcc 0
10 mol 176 unq 3 iso 0 dist 7.02608 7.31574 7.84713 12.9083 8.6431 7.63342 numMergedOcc 0
11 mol 239 unq 0 iso 0 dist 7.31087 12.2183 9.40943 7.54838 7.01673 11.6389 numMergedOcc 0
12 mol 247 unq 0 iso 0 dist 9.48468 13.1821 6.32156 6.6862 9.42253 11.6852 numMergedOcc 0
13 mol 255 unq 0 iso 0 dist 6.61193 4.76869 8.38114 5.09111 8.32084 4.9727 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 8.34471 8.11944 9.12231 4.2886 9.33223 5.05766 numMergedOcc 0
15 mol 259 unq 0 iso 0 dist 9.2772 10.7817 9.06386 5.5217 8.75224 12.7942 numMergedOcc 0
16 mol 265 unq 0 iso 0 dist 8.19772 5.34511 9.74602 11.5884 6.80043 13.1075 numMergedOcc 0
17 mol 268 unq 0 iso 0 dist 8.84415 7.26866 5.46063 12.9794 8.69312 5.92765 numMergedOcc 0
