0 mol 1 unq 0 iso 0 dist 9.72202 9.39338 8.56884 5.0634 6.09918 8.78328 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.80897 11.1917 6.73162 16.1274 8.44506 8.13684 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 8.37225 6.0365 6.73162 13.0741 8.44506 8.13684 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 8.77218 10.8271 8.97793 5.05789 4.79949 6.81799 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 8.77218 10.8271 8.97793 8.44806 7.27693 6.42322 numMergedOcc 0
5 mol 76 unq 2 iso 0 dist 8.77218 13.1819 8.19682 5.05789 4.79949 8.83525 numMergedOcc 0
6 mol 76 unq 3 iso 0 dist 8.77218 13.1819 8.19682 8.44806 7.27693 5.77727 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 7.11695 6.85223 8.36431 10.9332 6.61823 10.4141 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 7.11695 6.85223 8.36431 8.98815 6.49956 4.36639 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 9.41191 7.32599 5.87358 4.70745 5.34214 5.94311 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 8.86784 10.0815 8.6355 6.20072 5.53031 11.9544 numMergedOcc 0
11 mol 134 unq 1 iso 0 dist 9.16358 5.0903 8.79571 11.868 8.20836 9.65798 numMergedOcc 0
12 mol 178 unq 0 iso 0 dist 9.63185 6.70227 8.96511 6.80181 4.92088 7.07052 numMergedOcc 0
13 mol 195 unq 0 iso 0 dist 7.04524 10.9358 8.36117 4.52076 7.62942 9.08602 numMergedOcc 0
14 mol 195 unq 1 iso 0 dist 7.04524 7.60158 6.77578 4.52076 7.62942 8.18628 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 9.44947 12.7783 5.90931 4.80028 6.85441 10.7974 numMergedOcc 0
16 mol 209 unq 0 iso 0 dist 9.62543 12.5973 9.52027 3.88024 8.41195 9.02883 numMergedOcc 0
17 mol 214 unq 0 iso 0 dist 9.92165 4.40728 6.97182 13.4719 6.38157 9.26037 numMergedOcc 0
18 mol 214 unq 1 iso 0 dist 9.92165 5.75872 6.1175 13.4719 6.38157 11.353 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 5.39218 9.46015 6.84247 7.67381 5.45036 5.49803 numMergedOcc 0
20 mol 220 unq 1 iso 0 dist 5.39218 9.46015 6.84247 10.0433 9.97586 7.44322 numMergedOcc 0
21 mol 220 unq 2 iso 0 dist 5.39218 4.51612 6.99002 7.67381 5.45036 11.2241 numMergedOcc 0
22 mol 220 unq 3 iso 0 dist 5.39218 4.51612 6.99002 10.0433 9.97586 9.68359 numMergedOcc 0
23 mol 227 unq 0 iso 0 dist 8.27093 6.92493 8.17891 5.86596 8.38865 5.92529 numMergedOcc 0
24 mol 227 unq 1 iso 0 dist 9.02226 9.72888 9.62609 5.86596 5.4694 5.23507 numMergedOcc 0
25 mol 227 unq 2 iso 0 dist 9.02226 6.92493 6.95902 5.86596 5.4694 5.92529 numMergedOcc 0
26 mol 227 unq 3 iso 0 dist 9.78611 6.3793 8.83563 6.3262 5.87815 4.3387 numMergedOcc 0
27 mol 234 unq 0 iso 0 dist 5.46736 10.024 6.25105 9.52353 8.24186 13.0974 numMergedOcc 0
28 mol 236 unq 0 iso 0 dist 7.87233 4.71339 5.34718 15.7632 8.50331 11.6774 numMergedOcc 0
29 mol 238 unq 0 iso 0 dist 8.6771 8.92747 9.90142 6.60696 6.66971 5.8333 numMergedOcc 0
30 mol 238 unq 1 iso 0 dist 9.58767 10.8712 9.68513 6.60696 6.4398 6.48619 numMergedOcc 0
31 mol 238 unq 2 iso 0 dist 9.58767 8.92747 5.9216 6.60696 6.4398 5.8333 numMergedOcc 0
32 mol 276 unq 0 iso 0 dist 7.85804 7.32389 9.38971 8.19544 6.70215 5.86074 numMergedOcc 0
