0 mol 20 unq 0 iso 0 dist 9.98157 9.25293 7.5517 10.1466 3.59314 6.26206 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 9.74777 11.9066 9.41655 9.67696 7.02381 9.69752 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 9.74777 11.9066 9.41655 9.77113 14.1137 9.36461 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 7.63824 7.70921 5.02954 8.12171 4.11146 6.2004 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 5.11382 10.4706 9.65174 8.7263 9.63925 4.90592 numMergedOcc 0
5 mol 24 unq 4 iso 0 dist 5.11382 10.4706 9.65174 10.841 12.5427 8.16324 numMergedOcc 0
6 mol 63 unq 0 iso 0 dist 8.06894 5.60142 4.92457 8.01382 3.23074 5.53589 numMergedOcc 0
7 mol 63 unq 1 iso 0 dist 5.89846 4.84866 4.92457 7.77386 3.23074 5.53589 numMergedOcc 0
8 mol 93 unq 0 iso 0 dist 8.61597 3.74136 6.46217 7.29701 6.4154 7.62611 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 6.40989 8.69165 9.67274 8.82036 4.8632 6.76575 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 8.14978 5.44816 8.88454 10.6158 3.80087 9.78667 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 8.14978 5.44816 8.88454 6.93424 3.80763 6.73983 numMergedOcc 0
12 mol 141 unq 2 iso 0 dist 8.14978 5.44816 8.88454 6.8891 9.98068 7.64956 numMergedOcc 0
13 mol 141 unq 3 iso 0 dist 8.14978 9.06521 9.48581 10.6158 3.80087 8.47026 numMergedOcc 0
14 mol 141 unq 4 iso 0 dist 8.14978 9.06521 9.48581 6.93424 3.80763 8.6387 numMergedOcc 0
15 mol 147 unq 0 iso 0 dist 7.50372 4.52246 6.37938 9.52263 13.2259 7.25644 numMergedOcc 0
16 mol 147 unq 1 iso 0 dist 5.79819 5.88056 7.19893 12.6767 13.5462 7.25644 numMergedOcc 0
17 mol 147 unq 2 iso 0 dist 6.03024 5.88056 6.37938 12.6767 13.2259 7.25644 numMergedOcc 0
18 mol 158 unq 0 iso 0 dist 8.24681 7.85682 8.06621 13.5361 9.64397 6.76055 numMergedOcc 0
19 mol 158 unq 1 iso 0 dist 8.24681 7.85682 8.06621 12.2394 5.16839 9.36343 numMergedOcc 0
20 mol 158 unq 2 iso 0 dist 6.51748 4.19444 8.06621 10.1408 9.64397 6.76055 numMergedOcc 0
21 mol 158 unq 3 iso 0 dist 6.51748 4.19444 8.06621 10.0208 5.16839 9.36343 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 8.78251 17.0767 8.46395 13.8905 5.39534 5.45675 numMergedOcc 0
23 mol 194 unq 0 iso 0 dist 4.55528 5.5201 5.13892 7.71806 3.7326 6.37788 numMergedOcc 0
24 mol 194 unq 1 iso 0 dist 4.55528 6.55595 8.2232 7.71806 3.7326 8.7028 numMergedOcc 0
25 mol 194 unq 2 iso 0 dist 4.42095 5.5201 5.78717 7.71806 7.29209 6.37788 numMergedOcc 0
26 mol 194 unq 3 iso 0 dist 6.88386 4.41506 5.13892 9.59959 3.7326 6.37788 numMergedOcc 0
27 mol 194 unq 4 iso 0 dist 6.88386 10.4642 8.2232 9.59959 3.7326 8.7028 numMergedOcc 0
28 mol 194 unq 5 iso 0 dist 4.63898 4.41506 5.78717 9.59959 7.29209 6.37788 numMergedOcc 0
29 mol 194 unq 6 iso 0 dist 9.53641 14.6908 5.78717 15.4481 7.29209 6.37788 numMergedOcc 0
30 mol 205 unq 0 iso 0 dist 6.2669 10.0849 5.19567 19.2182 13.6793 9.17946 numMergedOcc 0
31 mol 218 unq 0 iso 0 dist 9.08818 12.5087 8.98941 14.8775 8.98584 8.3087 numMergedOcc 0
32 mol 252 unq 0 iso 0 dist 5.2116 9.34602 8.38453 8.35637 3.99887 7.39391 numMergedOcc 0
