0 mol 37 unq 0 iso 0 dist 9.15499 3.96491 9.59073 7.47638 6.28359 8.5893 numMergedOcc 0
1 mol 37 unq 1 iso 0 dist 9.15499 3.96491 9.59073 9.60381 14.1804 8.22608 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 9.77648 17.1322 9.08745 16.3456 6.98976 9.13024 numMergedOcc 0
3 mol 69 unq 1 iso 0 dist 9.18161 6.25587 9.08745 12.3276 6.98976 9.13024 numMergedOcc 0
4 mol 91 unq 0 iso 0 dist 6.64714 9.46631 7.71625 13.5508 10.5737 9.67751 numMergedOcc 0
5 mol 93 unq 0 iso 0 dist 5.46186 10.4525 9.67744 11.8247 6.76244 9.78342 numMergedOcc 0
6 mol 116 unq 0 iso 0 dist 5.93365 4.26914 7.54274 10.3957 7.97496 8.0237 numMergedOcc 0
7 mol 116 unq 1 iso 0 dist 6.99944 9.53399 7.54274 12.4295 7.97496 8.0237 numMergedOcc 0
8 mol 123 unq 0 iso 0 dist 6.49766 3.61945 4.14492 11.2204 6.95141 8.0933 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 5.24228 14.5965 9.92715 13.7515 9.00263 7.74168 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 8.10157 3.75216 5.12272 10.2474 8.49014 8.92048 numMergedOcc 0
11 mol 147 unq 1 iso 0 dist 8.10157 6.64419 8.7121 11.787 14.8893 8.84926 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 5.00402 8.73397 9.4366 10.4539 11.0504 8.45086 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 8.28282 12.5023 9.34653 12.7083 9.55695 7.62945 numMergedOcc 0
14 mol 251 unq 0 iso 0 dist 5.85851 3.46172 7.72528 9.71053 7.52349 9.20256 numMergedOcc 0
15 mol 264 unq 0 iso 0 dist 6.66615 3.9472 8.55386 9.03169 4.97003 9.26331 numMergedOcc 0
16 mol 279 unq 0 iso 0 dist 8.22717 5.61835 7.90632 8.7935 4.1816 7.72276 numMergedOcc 0
17 mol 279 unq 1 iso 0 dist 8.43409 11.2075 7.90632 11.8729 4.1816 7.72276 numMergedOcc 0
18 mol 279 unq 2 iso 0 dist 5.35326 3.83238 4.98693 5.90003 5.03747 5.16266 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 9.98518 3.76412 8.06767 8.85872 9.11127 9.2144 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 9.98518 3.76412 8.06767 8.85872 9.11127 9.2144 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 9.98518 3.76412 8.06767 8.85872 9.11127 9.2144 numMergedOcc 0
