0 mol 21 unq 0 iso 0 dist 8.58489 7.5289 8.33265 12.3004 10.6614 6.72231 numMergedOcc 0
1 mol 38 unq 0 iso 0 dist 5.11663 6.81855 6.70575 6.56791 4.28643 5.86243 numMergedOcc 0
2 mol 38 unq 1 iso 0 dist 5.11663 6.81855 6.70575 14.038 12.0803 7.55357 numMergedOcc 0
3 mol 38 unq 2 iso 0 dist 9.55714 7.85579 6.70575 11.8416 4.28643 5.86243 numMergedOcc 0
4 mol 38 unq 3 iso 0 dist 9.55714 7.85579 6.70575 14.3036 12.0803 7.55357 numMergedOcc 0
5 mol 109 unq 0 iso 0 dist 5.55005 5.20171 8.41492 11.0154 8.98907 8.59182 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 9.47443 7.43027 6.11155 11.7727 7.32598 9.95726 numMergedOcc 0
7 mol 132 unq 0 iso 0 dist 8.84518 10.3007 9.0788 11.8311 4.24969 8.15549 numMergedOcc 0
8 mol 206 unq 0 iso 0 dist 6.38821 6.16468 7.93451 11.9458 14.9665 8.93927 numMergedOcc 0
9 mol 230 unq 0 iso 0 dist 6.27573 5.58962 6.05795 9.87385 7.03151 6.23346 numMergedOcc 0
10 mol 239 unq 0 iso 0 dist 9.91899 13.8894 6.36178 8.49961 8.53372 8.34832 numMergedOcc 0
11 mol 239 unq 1 iso 0 dist 7.69106 9.39249 6.36178 11.3666 8.53372 8.34832 numMergedOcc 0
12 mol 245 unq 0 iso 0 dist 5.40784 6.5213 8.31511 8.03294 5.24264 7.26913 numMergedOcc 0
13 mol 245 unq 1 iso 0 dist 5.40784 13.8285 9.34253 8.03294 5.24264 8.69377 numMergedOcc 0
14 mol 264 unq 0 iso 0 dist 5.21387 5.7123 5.11475 9.91369 5.17977 7.61232 numMergedOcc 0
15 mol 285 unq 0 iso 0 dist 6.55498 14.401 9.0062 11.6641 5.29647 4.74716 numMergedOcc 0
16 mol 285 unq 1 iso 0 dist 7.38219 15.8124 8.64527 20.8923 13.7143 7.97209 numMergedOcc 0
17 mol 285 unq 2 iso 0 dist 7.38219 15.8124 8.64527 11.6641 6.56958 8.63954 numMergedOcc 0
18 mol 285 unq 3 iso 0 dist 7.38219 14.401 8.72607 11.6641 6.56958 4.74716 numMergedOcc 0
