0 mol 27 unq 0 iso 0 dist 6.68662 5.80623 5.92112 5.88339 9.52155 11.3725 numMergedOcc 0
1 mol 27 unq 1 iso 0 dist 6.68662 5.80623 5.92112 4.74995 9.16319 9.69276 numMergedOcc 0
2 mol 27 unq 2 iso 0 dist 9.11084 6.75307 6.50158 15.6378 9.52155 14.3096 numMergedOcc 0
3 mol 27 unq 3 iso 0 dist 9.11084 6.75307 6.50158 15.8581 9.16319 15.282 numMergedOcc 0
4 mol 27 unq 4 iso 0 dist 9.11084 7.24775 5.92112 15.6378 9.52155 11.3725 numMergedOcc 0
5 mol 27 unq 5 iso 0 dist 9.11084 7.24775 5.92112 15.8581 9.16319 9.69276 numMergedOcc 0
6 mol 28 unq 0 iso 0 dist 9.14653 6.68029 9.243 12.8342 8.96154 10.3582 numMergedOcc 0
7 mol 28 unq 1 iso 0 dist 9.14653 6.68029 9.243 14.4187 8.90935 10.7729 numMergedOcc 0
8 mol 71 unq 0 iso 0 dist 6.01135 5.70431 4.07844 8.91456 9.05335 11.6298 numMergedOcc 0
9 mol 91 unq 0 iso 0 dist 9.13904 8.99674 12.1497 6.524 5.16779 11.8321 numMergedOcc 0
10 mol 91 unq 1 iso 0 dist 7.10245 8.99674 9.73719 6.524 6.69121 11.8321 numMergedOcc 0
11 mol 123 unq 0 iso 0 dist 8.57379 5.98187 6.6925 7.36026 6.63094 8.90969 numMergedOcc 0
12 mol 123 unq 1 iso 0 dist 5.87154 7.42186 11.9106 6.45068 8.24171 8.90969 numMergedOcc 0
13 mol 123 unq 2 iso 0 dist 6.82663 7.42186 6.6925 6.45068 6.63094 8.90969 numMergedOcc 0
14 mol 123 unq 3 iso 0 dist 9.93167 9.47346 13.7302 7.09872 8.20345 15.8024 numMergedOcc 0
15 mol 123 unq 4 iso 0 dist 9.93167 9.47346 13.7302 6.36283 5.38148 8.90969 numMergedOcc 0
16 mol 148 unq 0 iso 0 dist 9.62458 9.92375 14.4323 6.53248 8.88297 14.3181 numMergedOcc 0
17 mol 196 unq 0 iso 0 dist 8.94535 6.67699 3.68546 10.7769 8.94198 6.14222 numMergedOcc 0
18 mol 278 unq 0 iso 0 dist 6.95272 8.71212 5.93697 5.55931 9.68335 13.5577 numMergedOcc 0
19 mol 278 unq 1 iso 0 dist 6.95272 8.60481 7.27472 5.55931 9.68335 7.1656 numMergedOcc 0
20 mol 286 unq 0 iso 0 dist 6.57496 7.97593 3.82706 8.51361 6.87255 9.21276 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 7.86603 5.62568 5.41757 10.0544 8.70479 7.99204 numMergedOcc 0
22 mol 287 unq 1 iso 0 dist 7.17626 8.82948 5.41757 6.23875 8.70479 7.99204 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 7.86603 5.62568 5.41757 10.0544 8.70479 7.99204 numMergedOcc 0
24 mol 288 unq 1 iso 0 dist 7.17626 8.82948 5.41757 6.23875 8.70479 7.99204 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 7.86603 5.62568 5.41757 10.0544 8.70479 7.99204 numMergedOcc 0
26 mol 289 unq 1 iso 0 dist 7.17626 8.82948 5.41757 6.23875 8.70479 7.99204 numMergedOcc 0
