0 mol 24 unq 0 iso 0 dist 6.94728 8.88399 6.74888 13.3625 8.7263 8.3964 numMergedOcc 0
1 mol 37 unq 0 iso 0 dist 8.28713 6.48296 4.2096 6.76395 11.1055 8.37816 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 8.38139 9.66461 8.5248 4.31769 10.1237 8.68989 numMergedOcc 0
3 mol 55 unq 0 iso 0 dist 5.12277 8.24934 10.1436 6.96815 9.3341 9.89804 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 7.52742 6.27877 4.75717 4.32784 10.6441 9.18097 numMergedOcc 0
5 mol 91 unq 0 iso 0 dist 8.42914 8.01351 10.1359 5.75219 7.42828 6.93893 numMergedOcc 0
6 mol 91 unq 1 iso 0 dist 8.17327 8.01351 11.3866 5.75219 5.98441 6.93893 numMergedOcc 0
7 mol 91 unq 2 iso 0 dist 9.52936 8.01351 9.36488 5.75219 5.45873 6.93893 numMergedOcc 0
8 mol 125 unq 0 iso 0 dist 7.0188 6.31546 11.9038 4.18419 10.4714 7.00113 numMergedOcc 0
9 mol 125 unq 1 iso 0 dist 7.0188 6.31546 11.9038 7.15048 13.2906 9.85979 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 9.1717 5.68406 8.04699 4.46354 7.57714 8.46376 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 8.8319 9.46329 8.04699 6.74216 7.57714 8.46376 numMergedOcc 0
12 mol 233 unq 0 iso 0 dist 6.28379 6.50096 7.15553 6.3638 12.5701 9.83883 numMergedOcc 0
13 mol 233 unq 1 iso 0 dist 9.29279 6.50096 10.2283 6.3638 14.0225 9.83883 numMergedOcc 0
14 mol 233 unq 2 iso 0 dist 8.91643 9.91416 7.15553 6.52401 12.5701 9.83883 numMergedOcc 0
15 mol 233 unq 3 iso 0 dist 8.79848 9.91416 10.2283 6.52401 14.0225 9.83883 numMergedOcc 0
16 mol 247 unq 0 iso 0 dist 6.52457 6.23164 10.2114 4.46 8.46644 6.29945 numMergedOcc 0
17 mol 278 unq 0 iso 0 dist 6.08019 9.79758 11.0702 4.19643 9.62872 8.30195 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 9.5174 8.93979 7.34826 15.151 16.334 9.24164 numMergedOcc 0
19 mol 280 unq 0 iso 0 dist 9.69573 7.31523 14.6308 9.27602 14.4897 8.47055 numMergedOcc 0
20 mol 280 unq 1 iso 0 dist 6.42515 7.61357 13.3704 6.58462 9.33975 7.42529 numMergedOcc 0
21 mol 280 unq 2 iso 0 dist 6.42515 8.67836 14.6308 10.0954 14.4897 8.47055 numMergedOcc 0
22 mol 280 unq 3 iso 0 dist 9.8581 7.61357 14.1092 6.58462 7.18775 7.42529 numMergedOcc 0
23 mol 280 unq 4 iso 0 dist 9.8581 8.67836 18.3519 10.0954 17.8613 8.47055 numMergedOcc 0
