0 mol 28 unq 0 iso 0 dist 5.9948 6.76158 11.7233 4.3475 8.76224 8.53424 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 5.9948 7.423 13.0183 4.3475 8.76224 7.08766 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 5.9948 5.89257 10.9699 4.3475 8.76224 4.82199 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 6.49446 6.0827 6.13411 5.4275 7.25138 4.46067 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 9.0101 8.26805 9.68005 6.27527 6.46582 7.66068 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 9.0101 9.68577 14.6547 6.27527 6.46582 9.5043 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 6.31509 5.91023 4.48773 5.90092 9.68556 6.5816 numMergedOcc 0
7 mol 98 unq 1 iso 0 dist 8.49806 5.91023 3.78499 5.90092 8.73928 6.5816 numMergedOcc 0
8 mol 120 unq 0 iso 0 dist 9.35529 8.31527 8.9188 5.79975 9.16089 7.84207 numMergedOcc 0
9 mol 120 unq 1 iso 0 dist 9.35529 7.64841 3.71884 5.37018 9.58434 9.31385 numMergedOcc 0
10 mol 120 unq 2 iso 0 dist 9.35529 7.64841 3.71884 5.79975 9.16089 6.98791 numMergedOcc 0
11 mol 176 unq 0 iso 0 dist 6.55106 6.32254 3.58164 5.25264 7.26558 6.85902 numMergedOcc 0
12 mol 176 unq 1 iso 0 dist 8.08891 8.89556 3.58164 3.97245 7.26558 6.85902 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 9.75853 7.82717 3.42324 4.32488 7.69952 4.87942 numMergedOcc 0
14 mol 186 unq 1 iso 0 dist 9.75853 8.19926 8.26669 4.32488 7.69952 7.25595 numMergedOcc 0
15 mol 243 unq 0 iso 0 dist 9.6748 8.35328 3.79865 6.56644 6.46793 4.55853 numMergedOcc 0
16 mol 260 unq 0 iso 0 dist 4.76689 7.22473 3.48905 7.91474 9.46576 8.62655 numMergedOcc 0
17 mol 260 unq 1 iso 0 dist 4.76689 6.02628 3.43711 5.30931 7.88108 7.04263 numMergedOcc 0
18 mol 260 unq 2 iso 0 dist 8.79012 7.13397 3.48905 4.38276 9.46576 8.62655 numMergedOcc 0
19 mol 260 unq 3 iso 0 dist 8.79012 5.33278 8.84611 8.90225 7.88108 6.48099 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 9.477 6.9943 3.87565 4.58167 7.93375 6.96692 numMergedOcc 0
21 mol 266 unq 1 iso 0 dist 9.477 7.36685 9.25882 4.58167 7.93375 8.25286 numMergedOcc 0
22 mol 266 unq 2 iso 0 dist 9.477 9.03099 12.1357 4.58167 7.93375 9.9965 numMergedOcc 0
