0 mol 13 unq 0 iso 0 dist 5.37391 5.04036 6.34527 4.17261 8.47514 6.26071 numMergedOcc 0
1 mol 13 unq 1 iso 0 dist 5.37391 5.04036 6.34527 6.68749 7.39086 8.43325 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 7.9399 7.34678 5.69805 4.47138 9.854 10.9948 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 7.9399 7.34678 5.69805 4.16095 8.23749 9.46994 numMergedOcc 0
4 mol 63 unq 0 iso 0 dist 8.20976 9.43893 5.18318 13.2118 8.79583 12.4695 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 6.64933 8.87924 11.2654 4.0486 9.54952 12.1018 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 6.29634 6.1835 7.55212 12.1192 8.20715 15.6203 numMergedOcc 0
7 mol 119 unq 1 iso 0 dist 6.29634 6.1835 7.55212 5.3154 6.16081 9.66471 numMergedOcc 0
8 mol 120 unq 0 iso 0 dist 5.90276 9.07172 4.80028 5.95039 8.5457 10.7631 numMergedOcc 0
9 mol 120 unq 1 iso 0 dist 5.90276 9.07172 4.80028 4.09501 6.7928 10.9338 numMergedOcc 0
10 mol 120 unq 2 iso 0 dist 5.90276 9.07172 4.80028 6.81436 7.59189 12.3252 numMergedOcc 0
11 mol 165 unq 0 iso 0 dist 5.94867 9.96052 5.5595 5.37365 5.50236 10.4612 numMergedOcc 0
12 mol 167 unq 0 iso 0 dist 6.00793 9.17387 8.73305 9.57777 6.85239 15.4782 numMergedOcc 0
13 mol 167 unq 1 iso 0 dist 6.00793 9.17387 8.73305 8.66436 5.72735 13.8512 numMergedOcc 0
14 mol 175 unq 0 iso 0 dist 8.49856 8.4673 3.87881 4.27736 6.62757 5.4969 numMergedOcc 0
15 mol 175 unq 1 iso 0 dist 8.49856 9.12296 11.923 4.27736 6.62757 7.35824 numMergedOcc 0
16 mol 214 unq 0 iso 0 dist 9.05875 4.94811 9.27733 7.65735 7.06087 10.5978 numMergedOcc 0
17 mol 243 unq 0 iso 0 dist 7.39089 5.66593 6.06595 14.0386 9.57009 14.2362 numMergedOcc 0
18 mol 251 unq 0 iso 0 dist 6.32455 9.08038 12.2548 12.3975 9.207 18.7407 numMergedOcc 0
