0 mol 9 unq 0 iso 0 dist 9.3359 17.4263 8.59513 12.1084 5.47 6.59312 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 8.44037 15.7371 8.26398 12.8267 6.66983 5.16502 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 9.04157 13.9547 7.94376 13.694 4.97344 5.59658 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 7.61514 15.3449 9.13593 8.21116 2.58673 8.25144 numMergedOcc 0
4 mol 85 unq 1 iso 0 dist 8.21116 15.3449 8.25144 7.61514 2.58673 9.13593 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 9.00481 5.95402 6.23759 9.12485 7.41778 5.35711 numMergedOcc 0
6 mol 135 unq 0 iso 0 dist 6.08242 4.75453 7.02963 12.8321 14.3156 8.72359 numMergedOcc 0
7 mol 135 unq 1 iso 0 dist 5.60595 4.14325 7.02963 12.5878 14.3156 8.72359 numMergedOcc 0
8 mol 169 unq 0 iso 0 dist 9.3206 7.21295 7.85698 13.7676 16.4124 8.75484 numMergedOcc 0
9 mol 169 unq 1 iso 0 dist 9.3206 6.08318 6.35799 9.31939 7.75905 5.41121 numMergedOcc 0
10 mol 182 unq 0 iso 0 dist 8.10542 13.7302 9.98182 16.4118 9.21043 9.02127 numMergedOcc 0
11 mol 182 unq 1 iso 0 dist 6.78641 5.41536 9.98182 10.863 9.21043 9.02127 numMergedOcc 0
12 mol 258 unq 0 iso 0 dist 8.86773 5.0607 8.31526 8.95095 8.91869 7.08328 numMergedOcc 0
13 mol 258 unq 1 iso 0 dist 8.95095 5.0607 7.08328 8.86773 8.91869 8.31526 numMergedOcc 0
14 mol 260 unq 0 iso 0 dist 7.22473 4.48112 6.49413 6.02628 5.97214 6.12343 numMergedOcc 0
15 mol 260 unq 1 iso 0 dist 7.22473 4.48112 6.49413 8.98856 8.11213 4.52405 numMergedOcc 0
16 mol 260 unq 2 iso 0 dist 6.02628 4.48112 6.12343 7.22473 5.97214 6.49413 numMergedOcc 0
17 mol 260 unq 3 iso 0 dist 6.02628 4.48112 6.12343 8.98856 8.76827 4.52405 numMergedOcc 0
18 mol 260 unq 4 iso 0 dist 7.13397 5.72956 6.49413 10.5948 5.97214 6.12343 numMergedOcc 0
19 mol 260 unq 5 iso 0 dist 7.13397 5.72956 6.49413 5.33278 8.11213 4.52405 numMergedOcc 0
20 mol 260 unq 6 iso 0 dist 5.33278 5.72956 4.52405 7.13397 8.11213 6.49413 numMergedOcc 0
21 mol 260 unq 7 iso 0 dist 5.33278 5.72956 4.52405 10.5948 8.76827 6.12343 numMergedOcc 0
22 mol 281 unq 0 iso 0 dist 8.78416 13.7467 6.18742 9.22428 3.77058 6.8089 numMergedOcc 0
23 mol 281 unq 1 iso 0 dist 9.22428 13.7467 6.8089 8.78416 3.77058 6.18742 numMergedOcc 0
24 mol 281 unq 2 iso 0 dist 7.82358 12.8593 6.18742 11.1162 3.77058 6.8089 numMergedOcc 0
25 mol 281 unq 3 iso 0 dist 7.95687 13.7172 6.8089 11.4532 3.77058 6.18742 numMergedOcc 0
