0 mol 19 unq 0 iso 0 dist 7.20519 7.75618 4.96411 5.5841 9.80108 7.02548 10.3056 9.32205 6.60936 8.19695 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 8.4674 8.40416 9.74255 6.74265 9.58539 7.02548 13.287 13.8916 6.60936 8.19695 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 8.4674 6.41575 4.64838 5.14627 6.20943 5.82366 14.129 10.943 10.4685 9.85134 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 4.54938 7.75618 9.74255 5.5841 9.58539 7.02548 10.3056 13.8916 6.60936 8.19695 numMergedOcc 0
4 mol 19 unq 4 iso 0 dist 4.54938 6.41575 4.97119 5.14627 7.82528 5.82366 14.129 15.119 10.4685 9.85134 numMergedOcc 0
5 mol 19 unq 5 iso 0 dist 7.82074 6.41575 6.01808 5.14627 10.2708 5.82366 14.129 14.6138 10.4685 9.85134 numMergedOcc 0
6 mol 19 unq 6 iso 0 dist 4.51865 8.40416 7.08342 6.74265 8.58657 7.02548 13.287 13.0631 6.60936 8.19695 numMergedOcc 0
7 mol 19 unq 7 iso 0 dist 4.51865 6.41423 4.64838 4.69858 6.20943 5.82366 13.212 10.943 10.4685 9.85134 numMergedOcc 0
8 mol 19 unq 8 iso 0 dist 6.864 7.75618 7.08342 5.5841 8.58657 7.02548 10.3056 13.0631 6.60936 8.19695 numMergedOcc 0
9 mol 19 unq 9 iso 0 dist 6.864 6.41423 4.97119 4.69858 7.82528 5.82366 13.212 15.119 10.4685 9.85134 numMergedOcc 0
10 mol 41 unq 0 iso 0 dist 6.19529 8.51663 8.94326 5.0364 9.68811 6.42834 11.6539 16.2387 10.1421 6.73801 numMergedOcc 0
11 mol 92 unq 0 iso 0 dist 7.4729 6.95572 9.50382 6.99832 5.81965 5.39745 10.5753 8.55834 6.34272 7.1539 numMergedOcc 0
12 mol 92 unq 1 iso 0 dist 6.82344 6.95572 7.56363 6.99832 9.70512 5.39745 10.5753 7.76866 6.34272 7.1539 numMergedOcc 0
13 mol 126 unq 0 iso 0 dist 6.06638 6.30546 6.0268 7.01257 7.75534 7.36017 10.0699 8.01268 6.71205 5.14819 numMergedOcc 0
14 mol 126 unq 1 iso 0 dist 6.06638 6.30546 6.0268 7.01257 7.75534 7.36017 12.8712 10.2072 10.7821 6.84245 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 7.11802 9.22232 16.0138 12.0863 16.3407 8.21165 12.817 19.1478 4.40317 7.41399 numMergedOcc 0
16 mol 133 unq 1 iso 0 dist 7.11802 9.22232 16.0138 12.0863 16.3407 8.21165 13.416 17.3514 10.8204 8.97945 numMergedOcc 0
17 mol 133 unq 2 iso 0 dist 7.11802 9.22232 16.0138 12.0863 16.3407 8.21165 17.1879 18.5594 16.3424 9.50664 numMergedOcc 0
18 mol 133 unq 3 iso 0 dist 7.11802 9.22232 16.0138 12.0863 16.3407 8.21165 16.1663 19.7615 12.3323 6.71555 numMergedOcc 0
19 mol 133 unq 4 iso 0 dist 7.11802 9.22661 5.92062 4.68409 7.92688 6.51868 7.56378 6.61891 7.33253 7.34698 numMergedOcc 0
20 mol 133 unq 5 iso 0 dist 7.11802 7.56378 6.61891 4.68409 7.92688 7.34698 9.22661 5.92062 7.33253 6.51868 numMergedOcc 0
21 mol 155 unq 0 iso 0 dist 6.43582 7.92304 5.50031 6.34186 7.51198 9.80845 10.3161 6.89781 6.56063 7.55196 numMergedOcc 0
22 mol 175 unq 0 iso 0 dist 6.57069 9.77896 8.29015 7.5414 9.8589 5.4997 14.2813 14.7282 6.75531 6.99693 numMergedOcc 0
23 mol 224 unq 0 iso 0 dist 9.40098 9.51597 4.98993 7.67202 11.1518 8.08737 11.6901 5.88416 4.48107 9.22384 numMergedOcc 0
24 mol 224 unq 1 iso 0 dist 6.61986 9.51597 12.4692 7.67202 12.6391 8.08737 11.6901 13.016 4.48107 9.22384 numMergedOcc 0
25 mol 234 unq 0 iso 0 dist 8.41436 7.32499 10.7902 13.2297 18.6592 7.94068 13.2078 17.5324 9.00021 7.22019 numMergedOcc 0
26 mol 234 unq 1 iso 0 dist 8.92474 7.32499 4.4288 13.2297 11.4702 7.94068 13.2078 10.3314 9.00021 7.22019 numMergedOcc 0
27 mol 238 unq 0 iso 0 dist 5.72887 9.24557 14.7883 11.0401 14.1514 8.90076 12.9364 17.6692 6.25098 6.62002 numMergedOcc 0
28 mol 238 unq 1 iso 0 dist 5.72887 9.24557 14.7883 8.85181 13.9989 6.87131 12.6066 18.2598 4.34277 8.81629 numMergedOcc 0
29 mol 238 unq 2 iso 0 dist 5.72887 9.24557 14.7883 8.85181 13.9989 6.87131 12.9364 17.6692 6.25098 9.69818 numMergedOcc 0
30 mol 238 unq 3 iso 0 dist 5.72887 9.24557 14.7883 11.9142 16.5748 8.09718 12.9364 17.6692 6.25098 6.73446 numMergedOcc 0
