0 mol 19 unq 0 iso 0 dist 7.20519 6.50337 7.16903 6.26585 12.2587 7.14945 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 4.54938 6.50337 10.2774 6.26585 10.5727 7.14945 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 6.864 6.50337 10.3465 6.26585 12.0534 7.14945 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 8.86116 6.48457 9.9259 14.6259 15.5324 8.80127 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 8.38394 6.48457 12.2071 14.6259 17.8264 8.80127 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 5.54419 8.80127 7.6222 14.6259 13.2433 6.48457 numMergedOcc 0
6 mol 24 unq 3 iso 0 dist 7.36323 8.80127 11.7026 14.6259 15.5296 6.48457 numMergedOcc 0
7 mol 43 unq 0 iso 0 dist 5.73819 9.07906 8.42544 10.6953 13.9655 8.75567 numMergedOcc 0
8 mol 43 unq 1 iso 0 dist 6.20293 9.07906 6.09486 10.6953 12.2321 8.75567 numMergedOcc 0
9 mol 43 unq 2 iso 0 dist 8.93915 9.07906 4.40385 10.6953 11.6828 8.75567 numMergedOcc 0
10 mol 54 unq 0 iso 0 dist 9.5589 8.41018 15.2053 10.8564 19.0337 7.11686 numMergedOcc 0
11 mol 54 unq 1 iso 0 dist 9.5589 8.41018 15.2053 7.90262 15.4771 9.43467 numMergedOcc 0
12 mol 85 unq 0 iso 0 dist 7.97049 8.77199 5.46695 5.42586 6.19965 8.81824 numMergedOcc 0
13 mol 85 unq 1 iso 0 dist 7.47541 8.77199 11.3211 5.42586 7.66905 8.81824 numMergedOcc 0
14 mol 85 unq 2 iso 0 dist 7.95579 8.81824 6.62562 5.42586 11.3023 8.77199 numMergedOcc 0
15 mol 85 unq 3 iso 0 dist 6.19965 8.81824 5.46695 5.42586 7.97049 8.77199 numMergedOcc 0
16 mol 85 unq 4 iso 0 dist 7.66905 8.81824 11.3211 5.42586 7.47541 8.77199 numMergedOcc 0
17 mol 119 unq 0 iso 0 dist 9.87172 8.20715 4.55137 9.22558 10.1813 6.16081 numMergedOcc 0
18 mol 119 unq 1 iso 0 dist 6.18601 6.16081 7.36889 9.22558 13.9919 8.20715 numMergedOcc 0
19 mol 127 unq 0 iso 0 dist 8.14887 8.82676 6.3084 6.16471 11.3474 8.17522 numMergedOcc 0
20 mol 127 unq 1 iso 0 dist 8.14887 8.82676 6.3084 11.2106 13.7695 8.14341 numMergedOcc 0
21 mol 127 unq 2 iso 0 dist 8.14887 8.82676 6.3084 12.2864 9.66262 6.54744 numMergedOcc 0
22 mol 127 unq 3 iso 0 dist 9.30299 8.82676 12.4721 6.16471 14.9565 8.17522 numMergedOcc 0
23 mol 127 unq 4 iso 0 dist 9.30299 8.82676 12.4721 11.2106 18.1486 8.14341 numMergedOcc 0
24 mol 127 unq 5 iso 0 dist 9.30299 8.82676 12.4721 12.2864 13.3014 6.54744 numMergedOcc 0
25 mol 152 unq 0 iso 0 dist 5.87555 8.86966 8.18329 5.49936 8.87437 5.7527 numMergedOcc 0
26 mol 152 unq 1 iso 0 dist 8.87437 5.7527 8.18329 5.49936 5.87555 8.86966 numMergedOcc 0
27 mol 152 unq 2 iso 0 dist 6.70283 8.86966 5.97115 5.49936 7.16148 5.7527 numMergedOcc 0
28 mol 152 unq 3 iso 0 dist 7.16148 5.7527 5.97115 5.49936 6.70283 8.86966 numMergedOcc 0
29 mol 152 unq 4 iso 0 dist 8.67331 8.86966 4.36394 5.49936 8.05741 5.7527 numMergedOcc 0
30 mol 152 unq 5 iso 0 dist 8.05741 5.7527 4.36394 5.49936 8.67331 8.86966 numMergedOcc 0
31 mol 167 unq 0 iso 0 dist 9.87651 5.72735 6.38496 4.70068 12.4733 6.85239 numMergedOcc 0
32 mol 178 unq 0 iso 0 dist 6.69288 8.4173 4.43082 11.7381 7.17202 6.55543 numMergedOcc 0
33 mol 178 unq 1 iso 0 dist 7.17202 6.55543 4.43082 11.7381 6.69288 8.4173 numMergedOcc 0
34 mol 206 unq 0 iso 0 dist 8.02137 6.11803 7.25848 5.63422 11.1804 9.73419 numMergedOcc 0
35 mol 206 unq 1 iso 0 dist 7.7366 9.73419 8.77621 5.63422 9.774 6.11803 numMergedOcc 0
36 mol 206 unq 2 iso 0 dist 9.774 6.11803 8.77621 5.63422 7.7366 9.73419 numMergedOcc 0
37 mol 258 unq 0 iso 0 dist 6.97229 5.8473 6.87078 5.55477 9.82663 7.98028 numMergedOcc 0
38 mol 258 unq 1 iso 0 dist 6.97229 6.78929 4.5427 5.55477 9.82663 8.13183 numMergedOcc 0
