0 mol 70 unq 0 iso 0 dist 9.28709 4.67358 7.98177 6.13606 9.81621 8.68801 numMergedOcc 0
1 mol 128 unq 0 iso 0 dist 9.36937 9.23513 12.02 9.95168 15.2992 4.58658 numMergedOcc 0
2 mol 146 unq 0 iso 0 dist 9.10374 5.38829 5.43323 8.73563 4.96984 7.20408 numMergedOcc 0
3 mol 146 unq 1 iso 0 dist 9.10374 5.38829 5.43323 7.92203 7.70916 6.00811 numMergedOcc 0
4 mol 146 unq 2 iso 0 dist 8.21621 7.498 5.43323 9.64915 4.96984 7.20408 numMergedOcc 0
5 mol 146 unq 3 iso 0 dist 8.21621 7.498 5.43323 6.75663 6.53228 7.59769 numMergedOcc 0
6 mol 198 unq 0 iso 0 dist 9.77781 5.33789 11.1573 6.73371 6.42799 9.86517 numMergedOcc 0
7 mol 198 unq 1 iso 0 dist 8.80253 5.33789 4.75457 6.73371 10.4394 9.86517 numMergedOcc 0
8 mol 206 unq 0 iso 0 dist 8.02547 8.65572 11.2335 9.24801 6.82269 15.7583 numMergedOcc 0
9 mol 206 unq 1 iso 0 dist 8.02547 8.39332 7.58792 9.24801 6.82269 6.24602 numMergedOcc 0
10 mol 226 unq 0 iso 0 dist 9.07455 6.50225 11.576 7.71605 5.87654 6.85639 numMergedOcc 0
11 mol 236 unq 0 iso 0 dist 7.89041 9.33359 6.35143 5.27184 6.01595 5.92456 numMergedOcc 0
12 mol 236 unq 1 iso 0 dist 7.89041 9.33359 6.35143 7.98527 4.93162 10.9807 numMergedOcc 0
13 mol 278 unq 0 iso 0 dist 9.03526 9.06043 5.37654 6.9592 15.4281 15.1214 numMergedOcc 0
14 mol 278 unq 1 iso 0 dist 8.03252 9.06043 14.615 6.9592 9.4448 15.1214 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 7.41656 9.79154 5.09662 8.25538 11.2057 10.8252 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 7.41656 9.79154 5.09662 8.25538 11.2057 10.8252 numMergedOcc 0
17 mol 289 unq 0 iso 0 dist 7.41656 9.79154 5.09662 8.25538 11.2057 10.8252 numMergedOcc 0
18 mol 292 unq 0 iso 0 dist 8.01956 9.65173 10.5255 9.01292 7.95758 4.92408 numMergedOcc 0
