0 mol 89 unq 0 iso 0 dist 8.45308 8.3977 6.36021 11.9488 6.28243 5.25504 numMergedOcc 0
1 mol 108 unq 0 iso 0 dist 6.29966 10.051 7.29462 10.3972 6.97518 5.45787 numMergedOcc 0
2 mol 108 unq 1 iso 0 dist 9.31725 15.8859 7.29462 13.1299 6.97518 5.45787 numMergedOcc 0
3 mol 108 unq 2 iso 0 dist 9.57358 14.7085 7.29462 11.8354 6.97518 5.45787 numMergedOcc 0
4 mol 108 unq 3 iso 0 dist 5.38329 4.56297 7.29462 5.8711 6.97518 5.45787 numMergedOcc 0
5 mol 108 unq 4 iso 0 dist 7.62421 4.56297 5.4057 5.8711 4.62224 5.45787 numMergedOcc 0
6 mol 110 unq 0 iso 0 dist 7.1891 7.92629 7.21229 12.5447 9.6516 8.93253 numMergedOcc 0
7 mol 110 unq 1 iso 0 dist 7.1891 4.65767 5.25492 12.5447 9.6516 8.1306 numMergedOcc 0
8 mol 110 unq 2 iso 0 dist 7.67702 9.86374 7.21229 10.7279 9.6516 8.93253 numMergedOcc 0
9 mol 110 unq 3 iso 0 dist 7.67702 5.33778 5.25492 10.7279 9.6516 8.1306 numMergedOcc 0
10 mol 111 unq 0 iso 0 dist 5.05141 4.41283 8.42147 5.68841 6.48732 7.42431 numMergedOcc 0
11 mol 178 unq 0 iso 0 dist 9.56963 16.8486 8.0974 14.506 7.17894 7.14849 numMergedOcc 0
12 mol 178 unq 1 iso 0 dist 9.56963 16.8486 8.0974 24.5715 15.0874 8.63718 numMergedOcc 0
13 mol 178 unq 2 iso 0 dist 5.95885 11.6817 8.0974 10.1357 7.17894 7.14849 numMergedOcc 0
14 mol 178 unq 3 iso 0 dist 5.95885 11.6817 8.0974 19.9162 15.0874 8.63718 numMergedOcc 0
15 mol 196 unq 0 iso 0 dist 8.62618 8.07956 6.76923 13.7387 13.7733 7.23126 numMergedOcc 0
16 mol 196 unq 1 iso 0 dist 8.62618 8.07956 6.76923 14.0883 12.3428 7.82805 numMergedOcc 0
17 mol 198 unq 0 iso 0 dist 7.2078 10.5082 6.47339 19.2934 13.3321 9.98332 numMergedOcc 0
18 mol 224 unq 0 iso 0 dist 9.47309 10.5254 6.56437 16.3508 13.0098 9.61379 numMergedOcc 0
19 mol 234 unq 0 iso 0 dist 9.5831 11.5103 5.89084 13.2937 3.90122 7.17032 numMergedOcc 0
20 mol 265 unq 0 iso 0 dist 5.14122 11.5005 9.59213 15.8624 13.0023 5.89409 numMergedOcc 0
21 mol 265 unq 1 iso 0 dist 5.14122 11.5005 9.59213 16.4289 12.5955 7.45719 numMergedOcc 0
