0 mol 7 unq 0 iso 0 dist 8.36111 17.4437 9.87885 17.164 10.1841 9.68596 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 9.08552 5.12111 6.56356 11.2151 4.1204 7.03958 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 9.08552 13.7837 9.01112 11.2151 4.1204 7.18019 numMergedOcc 0
3 mol 8 unq 2 iso 0 dist 9.08552 8.69443 7.62333 11.2151 4.1204 8.44009 numMergedOcc 0
4 mol 9 unq 0 iso 0 dist 9.47528 7.50668 8.30653 14.3947 10.6575 7.32257 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 9.39274 11.5983 7.99919 11.0789 6.19011 6.85556 numMergedOcc 0
6 mol 25 unq 1 iso 0 dist 9.95169 4.96681 9.48085 10.2461 9.62058 6.16347 numMergedOcc 0
7 mol 25 unq 2 iso 0 dist 9.95169 4.96681 9.48085 8.00738 10.2758 7.92503 numMergedOcc 0
8 mol 25 unq 3 iso 0 dist 9.95169 12.2441 9.49421 10.2461 9.62058 7.45383 numMergedOcc 0
9 mol 25 unq 4 iso 0 dist 9.95169 12.2441 9.49421 13.6671 5.38592 9.01548 numMergedOcc 0
10 mol 68 unq 0 iso 0 dist 7.41141 8.36943 6.17207 8.38855 3.85627 7.26024 numMergedOcc 0
11 mol 68 unq 1 iso 0 dist 7.41141 8.36943 6.17207 12.5354 7.15683 6.36086 numMergedOcc 0
12 mol 72 unq 0 iso 0 dist 8.16985 11.6369 7.12321 16.4419 14.005 9.27838 numMergedOcc 0
13 mol 73 unq 0 iso 0 dist 9.47628 7.43704 8.72682 12.3352 13.952 6.02816 numMergedOcc 0
14 mol 98 unq 0 iso 0 dist 6.74197 12.31 9.64383 11.8581 12.82 7.23884 numMergedOcc 0
15 mol 98 unq 1 iso 0 dist 6.74197 11.0642 7.54889 8.48678 3.92737 4.47349 numMergedOcc 0
16 mol 98 unq 2 iso 0 dist 6.74197 7.71768 7.78931 8.48678 3.92737 5.65185 numMergedOcc 0
17 mol 100 unq 0 iso 0 dist 5.30117 5.92158 5.35782 12.1601 8.00947 7.38135 numMergedOcc 0
18 mol 168 unq 0 iso 0 dist 5.21801 7.26802 6.02086 8.30857 4.02702 7.44629 numMergedOcc 0
19 mol 184 unq 0 iso 0 dist 9.07247 7.25468 5.96423 6.65725 4.67256 6.42735 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 7.12029 5.77884 6.61112 10.8472 4.03697 8.73217 numMergedOcc 0
21 mol 235 unq 0 iso 0 dist 6.50932 14.2513 8.19317 14.6546 10.0135 8.69356 numMergedOcc 0
22 mol 243 unq 0 iso 0 dist 5.54003 7.95216 8.67156 9.11142 4.21383 8.76935 numMergedOcc 0
23 mol 243 unq 1 iso 0 dist 5.54003 7.95216 8.67156 9.9718 6.94795 8.47652 numMergedOcc 0
24 mol 273 unq 0 iso 0 dist 8.28809 6.69098 9.59325 8.16005 3.78984 8.49177 numMergedOcc 0
25 mol 279 unq 0 iso 0 dist 8.76604 5.85038 7.24366 10.4383 4.05042 7.23721 numMergedOcc 0
