0 mol 9 unq 0 iso 0 dist 7.61784 10.7529 8.79695 8.03595 5.92069 9.39983 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 7.61784 10.7529 8.79695 5.04774 4.97354 11.0466 numMergedOcc 0
2 mol 27 unq 0 iso 0 dist 7.45989 5.23976 8.3189 8.99455 6.32509 8.69235 numMergedOcc 0
3 mol 27 unq 1 iso 0 dist 7.45989 4.40894 5.02965 8.99455 6.32509 4.60687 numMergedOcc 0
4 mol 27 unq 2 iso 0 dist 7.45989 7.69828 7.49305 8.99455 6.32509 5.07229 numMergedOcc 0
5 mol 44 unq 0 iso 0 dist 9.12595 10.6323 8.49525 11.7723 6.15703 4.38569 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 4.82824 3.61874 7.70787 8.31625 9.8821 5.89334 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 4.82824 3.61874 7.70787 8.16941 8.80003 6.63464 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 9.46867 13.7144 9.57191 4.53367 8.40154 10.1688 numMergedOcc 0
9 mol 81 unq 0 iso 0 dist 9.78763 11.2863 6.22059 15.3166 9.13248 4.57548 numMergedOcc 0
10 mol 81 unq 1 iso 0 dist 9.78763 11.2863 6.22059 4.76773 9.03754 8.00722 numMergedOcc 0
11 mol 105 unq 0 iso 0 dist 9.22294 9.42319 8.03876 7.22468 8.19346 8.61416 numMergedOcc 0
12 mol 114 unq 0 iso 0 dist 5.29259 4.64006 6.8458 5.64342 9.68809 6.76815 numMergedOcc 0
13 mol 120 unq 0 iso 0 dist 9.17864 9.43335 6.84082 15.2723 8.02616 7.77274 numMergedOcc 0
14 mol 120 unq 1 iso 0 dist 9.17864 9.71207 8.66256 15.2723 8.02616 10.778 numMergedOcc 0
15 mol 120 unq 2 iso 0 dist 9.17864 12.1938 8.08194 15.2723 8.02616 4.95 numMergedOcc 0
16 mol 120 unq 3 iso 0 dist 9.17864 16.9923 9.89622 15.2723 8.02616 4.88697 numMergedOcc 0
17 mol 120 unq 4 iso 0 dist 9.39373 6.90523 6.84082 14.2191 8.02616 7.77274 numMergedOcc 0
18 mol 120 unq 5 iso 0 dist 9.39373 4.81408 8.66256 14.2191 8.02616 10.778 numMergedOcc 0
19 mol 120 unq 6 iso 0 dist 9.39373 11.8812 8.08194 14.2191 8.02616 4.95 numMergedOcc 0
20 mol 120 unq 7 iso 0 dist 9.39373 14.0826 9.89622 14.2191 8.02616 4.88697 numMergedOcc 0
21 mol 174 unq 0 iso 0 dist 8.01716 4.08823 8.99695 11.7284 9.79225 8.91644 numMergedOcc 0
22 mol 222 unq 0 iso 0 dist 6.70789 9.27187 8.33743 4.56851 8.60727 13.0561 numMergedOcc 0
23 mol 242 unq 0 iso 0 dist 9.84875 12.6596 8.75712 9.46472 5.97464 5.22346 numMergedOcc 0
24 mol 266 unq 0 iso 0 dist 8.93788 10.204 7.01175 8.96584 9.96942 4.39397 numMergedOcc 0
25 mol 266 unq 1 iso 0 dist 8.93788 13.1038 7.50074 8.96584 9.96942 9.47559 numMergedOcc 0
26 mol 287 unq 0 iso 0 dist 7.64453 9.99556 6.08044 10.0056 9.82863 8.76196 numMergedOcc 0
27 mol 287 unq 1 iso 0 dist 7.64453 7.32623 8.8956 10.0056 9.82863 10.0477 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 7.64453 9.99556 6.08044 10.0056 9.82863 8.76196 numMergedOcc 0
29 mol 288 unq 1 iso 0 dist 7.64453 7.32623 8.8956 10.0056 9.82863 10.0477 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 7.64453 9.99556 6.08044 10.0056 9.82863 8.76196 numMergedOcc 0
31 mol 289 unq 1 iso 0 dist 7.64453 7.32623 8.8956 10.0056 9.82863 10.0477 numMergedOcc 0
