0 mol 26 unq 0 iso 0 dist 9.12845 14.1424 9.06516 11.5008 8.97754 7.97596 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.12845 6.10146 9.96121 11.5008 8.97754 8.62111 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 7.18022 5.32981 7.79336 13.1004 9.41098 16.3505 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 7.28228 5.50513 7.11695 4.32161 9.32314 9.15119 numMergedOcc 0
4 mol 53 unq 1 iso 0 dist 7.28228 10.8486 7.58093 4.32161 9.32314 14.2778 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 9.97769 10.3598 8.13051 11.884 9.10675 10.5052 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 9.32706 6.00578 8.13051 12.0104 9.10675 10.5052 numMergedOcc 0
7 mol 58 unq 2 iso 0 dist 9.08221 11.6697 8.13051 5.87468 9.10675 10.5052 numMergedOcc 0
8 mol 62 unq 0 iso 0 dist 9.69044 11.7069 9.1062 14.3608 9.19512 5.27573 numMergedOcc 0
9 mol 62 unq 1 iso 0 dist 6.9103 5.49555 9.1062 5.9487 9.19512 5.27573 numMergedOcc 0
10 mol 67 unq 0 iso 0 dist 8.3733 10.331 8.96498 4.04753 5.88409 11.4786 numMergedOcc 0
11 mol 72 unq 0 iso 0 dist 9.55118 7.11552 5.4605 16.024 8.80645 9.32129 numMergedOcc 0
12 mol 72 unq 1 iso 0 dist 9.55118 12.3903 6.1906 16.024 8.80645 4.00728 numMergedOcc 0
13 mol 72 unq 2 iso 0 dist 9.55118 7.17489 6.7272 16.024 8.80645 10.0349 numMergedOcc 0
14 mol 134 unq 0 iso 0 dist 9.10524 14.0644 5.73203 14.9489 6.76852 5.45 numMergedOcc 0
15 mol 134 unq 1 iso 0 dist 5.35237 8.96357 6.57379 7.89899 4.94473 5.45 numMergedOcc 0
16 mol 134 unq 2 iso 0 dist 9.00918 5.9915 5.73203 9.39407 6.76852 5.45 numMergedOcc 0
17 mol 134 unq 3 iso 0 dist 7.99477 5.9915 6.57379 9.39407 4.94473 5.45 numMergedOcc 0
18 mol 143 unq 0 iso 0 dist 5.40637 5.44503 7.46803 6.75249 6.60366 4.19541 numMergedOcc 0
19 mol 168 unq 0 iso 0 dist 6.02086 8.67522 7.06851 12.7437 8.21227 7.8982 numMergedOcc 0
20 mol 225 unq 0 iso 0 dist 8.1945 10.7506 8.91356 14.2198 8.74463 16.5061 numMergedOcc 0
21 mol 225 unq 1 iso 0 dist 8.1945 7.12954 9.59574 14.2198 8.74463 10.2743 numMergedOcc 0
22 mol 225 unq 2 iso 0 dist 6.50998 8.69249 8.91356 9.72811 8.74463 16.5061 numMergedOcc 0
23 mol 225 unq 3 iso 0 dist 6.50998 14.2819 9.59574 9.72811 8.74463 10.2743 numMergedOcc 0
24 mol 272 unq 0 iso 0 dist 6.44147 6.64985 8.84523 5.00122 5.53492 9.97731 numMergedOcc 0
25 mol 287 unq 0 iso 0 dist 7.45616 7.23534 8.59762 3.65199 4.93516 8.99193 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 7.45616 7.23534 8.59762 3.65199 4.93516 8.99193 numMergedOcc 0
27 mol 289 unq 0 iso 0 dist 7.45616 7.23534 8.59762 3.65199 4.93516 8.99193 numMergedOcc 0
