0 mol 34 unq 0 iso 0 dist 7.87317 9.95442 9.36125 10.0293 9.18109 15.4668 numMergedOcc 0
1 mol 92 unq 0 iso 0 dist 7.44186 8.20798 4.98716 4.01477 6.59382 7.00606 numMergedOcc 0
2 mol 98 unq 0 iso 0 dist 5.8785 5.84244 5.34199 4.61855 6.69328 8.46477 numMergedOcc 0
3 mol 100 unq 0 iso 0 dist 6.98876 6.18729 5.07584 6.08419 6.97361 7.90328 numMergedOcc 0
4 mol 110 unq 0 iso 0 dist 7.67702 9.58164 5.17209 9.62408 6.70591 11.766 numMergedOcc 0
5 mol 110 unq 1 iso 0 dist 7.67702 9.58164 5.17209 10.5488 5.43052 9.29817 numMergedOcc 0
6 mol 117 unq 0 iso 0 dist 5.38954 9.77482 12.4058 8.64874 6.81489 16.4461 numMergedOcc 0
7 mol 117 unq 1 iso 0 dist 5.38954 9.0428 9.30367 8.64874 6.81489 8.0578 numMergedOcc 0
8 mol 123 unq 0 iso 0 dist 6.36344 9.07289 7.07913 4.99882 7.97266 6.7201 numMergedOcc 0
9 mol 151 unq 0 iso 0 dist 8.96469 9.14139 4.18547 4.20596 9.74969 8.00027 numMergedOcc 0
10 mol 205 unq 0 iso 0 dist 7.9678 9.70674 12.652 7.44958 6.09754 15.2707 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 8.98518 5.02756 5.34316 10.1177 8.65696 10.7943 numMergedOcc 0
12 mol 234 unq 0 iso 0 dist 9.5831 6.553 11.2839 5.55026 9.36753 10.0197 numMergedOcc 0
13 mol 234 unq 1 iso 0 dist 9.5831 6.5097 11.9454 5.55026 9.36753 7.24774 numMergedOcc 0
14 mol 238 unq 0 iso 0 dist 5.59164 9.13022 6.23871 6.16765 9.46728 9.46582 numMergedOcc 0
15 mol 259 unq 0 iso 0 dist 8.13376 5.68415 11.3446 11.3955 7.97113 10.5745 numMergedOcc 0
16 mol 259 unq 1 iso 0 dist 8.13376 5.68415 11.3446 9.8442 8.38479 9.9591 numMergedOcc 0
17 mol 265 unq 0 iso 0 dist 5.14122 5.88787 4.98228 9.76011 6.98812 10.322 numMergedOcc 0
