0 mol 33 unq 0 iso 0 dist 5.65377 9.06004 3.82411 9.34266 4.28598 4.43305 numMergedOcc 0
1 mol 33 unq 0 iso 1 dist 5.65377 9.34266 4.28598 9.06004 3.82411 4.43305 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 6.47185 9.942 15.3318 5.92771 3.8412 14.4922 numMergedOcc 0
3 mol 46 unq 0 iso 1 dist 6.47185 5.92771 3.8412 9.942 15.3318 14.4922 numMergedOcc 0
4 mol 55 unq 0 iso 0 dist 8.51194 8.77395 11.6528 6.91288 13.561 5.43051 numMergedOcc 0
5 mol 55 unq 0 iso 1 dist 8.51194 6.91288 13.561 8.77395 11.6528 5.43051 numMergedOcc 0
6 mol 55 unq 1 iso 0 dist 8.51194 8.77395 11.6528 8.60087 8.00205 4.78168 numMergedOcc 0
7 mol 55 unq 1 iso 1 dist 8.51194 8.60087 8.00205 8.77395 11.6528 4.78168 numMergedOcc 0
8 mol 55 unq 1 iso 0 dist 8.51194 6.91288 13.561 8.60087 8.00205 8.93213 numMergedOcc 0
9 mol 55 unq 1 iso 1 dist 8.51194 8.60087 8.00205 6.91288 13.561 8.93213 numMergedOcc 0
10 mol 83 unq 0 iso 0 dist 9.54935 6.72584 6.46071 7.25594 3.96895 5.72008 numMergedOcc 0
11 mol 83 unq 0 iso 1 dist 9.54935 7.25594 3.96895 6.72584 6.46071 5.72008 numMergedOcc 0
12 mol 112 unq 0 iso 0 dist 7.59407 7.87345 10.207 9.01196 4.52589 10.8895 numMergedOcc 0
13 mol 112 unq 0 iso 1 dist 7.59407 9.01196 4.52589 7.87345 10.207 10.8895 numMergedOcc 0
14 mol 123 unq 0 iso 0 dist 9.22679 5.18305 9.35964 6.13025 5.76711 7.48549 numMergedOcc 0
15 mol 123 unq 0 iso 1 dist 9.22679 6.13025 5.76711 5.18305 9.35964 7.48549 numMergedOcc 0
16 mol 123 unq 1 iso 0 dist 9.22679 5.18305 9.35964 6.78431 7.69442 8.29136 numMergedOcc 0
17 mol 123 unq 1 iso 1 dist 9.22679 6.78431 7.69442 5.18305 9.35964 8.29136 numMergedOcc 0
18 mol 123 unq 1 iso 0 dist 9.22679 6.13025 5.76711 6.78431 7.69442 9.29446 numMergedOcc 0
19 mol 123 unq 1 iso 1 dist 9.22679 6.78431 7.69442 6.13025 5.76711 9.29446 numMergedOcc 0
20 mol 265 unq 0 iso 0 dist 5.90175 9.19805 3.8221 7.71301 3.5393 5.7556 numMergedOcc 0
21 mol 265 unq 0 iso 1 dist 5.90175 7.71301 3.5393 9.19805 3.8221 5.7556 numMergedOcc 0
22 mol 283 unq 0 iso 0 dist 9.72248 8.3831 6.30031 8.44179 8.78323 5.13178 numMergedOcc 0
23 mol 283 unq 0 iso 1 dist 9.72248 8.44179 8.78323 8.3831 6.30031 5.13178 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 7.80478 6.23874 3.76412 6.68956 5.39384 4.68872 numMergedOcc 0
25 mol 287 unq 0 iso 1 dist 7.80478 6.68956 5.39384 6.23874 3.76412 4.68872 numMergedOcc 0
26 mol 287 unq 1 iso 0 dist 7.26294 6.17759 4.13973 8.20391 7.1669 4.64789 numMergedOcc 0
27 mol 287 unq 1 iso 1 dist 7.26294 8.20391 7.1669 6.17759 4.13973 4.64789 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 7.80478 6.23874 3.76412 6.68956 5.39384 4.68872 numMergedOcc 0
29 mol 288 unq 0 iso 1 dist 7.80478 6.68956 5.39384 6.23874 3.76412 4.68872 numMergedOcc 0
30 mol 288 unq 1 iso 0 dist 7.26294 6.17759 4.13973 8.20391 7.1669 4.64789 numMergedOcc 0
31 mol 288 unq 1 iso 1 dist 7.26294 8.20391 7.1669 6.17759 4.13973 4.64789 numMergedOcc 0
32 mol 289 unq 0 iso 0 dist 7.80478 6.23874 3.76412 6.68956 5.39384 4.68872 numMergedOcc 0
33 mol 289 unq 0 iso 1 dist 7.80478 6.68956 5.39384 6.23874 3.76412 4.68872 numMergedOcc 0
34 mol 289 unq 1 iso 0 dist 7.26294 6.17759 4.13973 8.20391 7.1669 4.64789 numMergedOcc 0
35 mol 289 unq 1 iso 1 dist 7.26294 8.20391 7.1669 6.17759 4.13973 4.64789 numMergedOcc 0
