0 mol 0 unq 0 iso 0 dist 8.38106 6.64852 6.8892 4.29247 9.33581 9.9221 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 8.38106 6.64852 6.8892 11.4161 9.17422 6.20282 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 5.70193 6.26414 6.8892 12.3568 9.33581 9.9221 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 5.70193 6.26414 6.8892 10.598 9.17422 6.20282 numMergedOcc 0
4 mol 6 unq 0 iso 0 dist 9.38351 13.9523 6.36157 14.9813 9.33311 5.38115 numMergedOcc 0
5 mol 8 unq 0 iso 0 dist 6.68091 4.04843 8.68949 12.2884 9.19009 14.0069 numMergedOcc 0
6 mol 87 unq 0 iso 0 dist 6.97882 6.27329 5.62336 6.39639 8.28654 7.73223 numMergedOcc 0
7 mol 87 unq 1 iso 0 dist 7.7858 7.88443 5.62336 6.78332 8.28654 7.73223 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 9.96416 5.9683 5.79195 5.21715 8.60257 4.19526 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 5.9962 5.9683 8.76088 5.21715 7.7342 4.19526 numMergedOcc 0
10 mol 133 unq 2 iso 0 dist 5.9962 5.9683 8.76088 14.5343 9.79873 13.269 numMergedOcc 0
11 mol 133 unq 3 iso 0 dist 8.61448 13.8877 8.76088 10.3044 7.7342 4.19526 numMergedOcc 0
12 mol 133 unq 4 iso 0 dist 8.61448 13.8877 8.76088 12.256 9.79873 13.269 numMergedOcc 0
13 mol 187 unq 0 iso 0 dist 5.82577 10.7172 5.58167 10.2206 6.94036 4.03131 numMergedOcc 0
14 mol 187 unq 1 iso 0 dist 5.82577 4.75665 8.0501 10.2206 6.94036 9.89541 numMergedOcc 0
15 mol 225 unq 0 iso 0 dist 7.47852 5.9027 7.65121 6.86366 5.69711 9.8881 numMergedOcc 0
16 mol 225 unq 1 iso 0 dist 6.22332 4.95393 7.65121 5.92867 5.69711 9.8881 numMergedOcc 0
17 mol 226 unq 0 iso 0 dist 7.54614 12.983 8.74399 5.13739 5.78519 10.618 numMergedOcc 0
18 mol 244 unq 0 iso 0 dist 9.53211 11.4783 7.43391 9.56055 8.47853 14.9447 numMergedOcc 0
19 mol 244 unq 1 iso 0 dist 9.53211 4.30655 7.79787 9.56055 8.47853 5.82417 numMergedOcc 0
20 mol 246 unq 0 iso 0 dist 9.22642 4.72541 8.16617 13.2938 8.83826 9.20753 numMergedOcc 0
21 mol 246 unq 1 iso 0 dist 7.63397 6.06278 8.16617 5.5186 8.83826 9.20753 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 9.17911 15.4705 8.10903 4.72437 8.58595 12.495 numMergedOcc 0
23 mol 258 unq 1 iso 0 dist 9.17911 13.8539 7.25618 4.72437 8.58595 11.0189 numMergedOcc 0
24 mol 258 unq 2 iso 0 dist 9.52903 5.66907 8.10903 16.2778 8.58595 12.495 numMergedOcc 0
25 mol 258 unq 3 iso 0 dist 9.52903 9.6053 7.25618 16.2778 8.58595 11.0189 numMergedOcc 0
26 mol 266 unq 0 iso 0 dist 9.33791 8.55958 8.8646 4.87626 9.70363 7.9907 numMergedOcc 0
27 mol 293 unq 0 iso 0 dist 6.83404 5.86662 6.42608 4.97852 8.58317 5.0535 numMergedOcc 0
28 mol 293 unq 1 iso 0 dist 6.04186 6.74585 4.72125 9.30676 8.36747 5.0535 numMergedOcc 0
