0 mol 33 unq 0 iso 0 dist 8.41842 10.1727 7.44828 3.93232 6.53195 11.1555 15.6953 9.9897 8.74487 14.8932 numMergedOcc 0
1 mol 63 unq 0 iso 0 dist 9.1662 3.86843 6.49343 14.4144 7.85738 12.6017 11.6253 12.2413 9.78739 20.0078 numMergedOcc 0
2 mol 79 unq 0 iso 0 dist 8.01516 15.8477 8.64686 12.5904 6.65972 4.13187 20.5433 12.6473 8.61089 11.6139 numMergedOcc 0
3 mol 79 unq 1 iso 0 dist 8.01516 15.8477 8.64686 7.80434 4.2253 9.13196 20.5433 12.6473 8.61089 14.2202 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 9.96416 5.9683 5.79195 8.87194 9.35049 4.63862 7.17051 12.1681 9.2759 10.3668 numMergedOcc 0
5 mol 133 unq 1 iso 0 dist 9.96416 5.9683 5.79195 8.87194 9.35049 4.63862 5.9962 9.34083 8.76088 13.1234 numMergedOcc 0
6 mol 204 unq 0 iso 0 dist 8.40718 12.4189 6.20044 16.6893 8.77524 6.42785 12.2846 8.63339 6.62514 12.104 numMergedOcc 0
7 mol 204 unq 1 iso 0 dist 8.40718 12.4189 6.20044 16.6893 8.77524 6.42785 17.6118 11.09 9.41996 10.9304 numMergedOcc 0
8 mol 211 unq 0 iso 0 dist 9.26542 9.86881 5.6998 6.3032 5.49212 3.65651 14.7751 5.59365 8.10779 9.93639 numMergedOcc 0
9 mol 211 unq 1 iso 0 dist 9.26542 9.86881 5.6998 6.17106 9.79135 6.99357 14.7751 5.59365 8.10779 14.3194 numMergedOcc 0
10 mol 277 unq 0 iso 0 dist 6.70414 12.5633 8.15119 7.31817 4.1545 9.21484 16.5458 11.3688 6.66936 10.4606 numMergedOcc 0
11 mol 277 unq 1 iso 0 dist 6.70414 12.5633 8.15119 3.91224 4.25172 10.3506 16.5458 11.3688 6.66936 13.1741 numMergedOcc 0
12 mol 283 unq 0 iso 0 dist 8.89292 4.02114 9.28067 6.39025 5.38739 8.09099 8.43009 7.89565 5.71075 10.1143 numMergedOcc 0
13 mol 287 unq 0 iso 0 dist 7.47179 6.53276 6.45597 5.42266 8.73403 3.65914 10.6184 5.69849 9.18785 10.5085 numMergedOcc 0
14 mol 288 unq 0 iso 0 dist 7.47179 6.53276 6.45597 5.42266 8.73403 3.65914 10.6184 5.69849 9.18785 10.5085 numMergedOcc 0
15 mol 289 unq 0 iso 0 dist 7.47179 6.53276 6.45597 5.42266 8.73403 3.65914 10.6184 5.69849 9.18785 10.5085 numMergedOcc 0
