0 mol 7 unq 0 iso 0 dist 6.66645 12.1978 5.72491 13.4908 10.1959 8.72114 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.66645 4.78012 7.88043 7.13214 7.25346 5.99972 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 5.22017 4.78012 8.80762 7.13214 10.0658 5.99972 numMergedOcc 0
3 mol 8 unq 0 iso 0 dist 7.70793 14.4127 6.82379 11.2348 5.65816 7.03958 numMergedOcc 0
4 mol 8 unq 1 iso 0 dist 7.70793 8.93161 7.3915 11.2348 5.65816 8.53529 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 6.98291 6.32132 6.6492 13.096 11.7817 7.45383 numMergedOcc 0
6 mol 25 unq 1 iso 0 dist 6.98291 6.32132 6.6492 12.7595 9.12941 9.01548 numMergedOcc 0
7 mol 44 unq 0 iso 0 dist 5.06773 9.6925 7.52117 10.1339 5.1728 9.6782 numMergedOcc 0
8 mol 44 unq 1 iso 0 dist 8.2444 14.7948 7.52117 11.8567 5.1728 9.6782 numMergedOcc 0
9 mol 56 unq 0 iso 0 dist 8.58057 9.16445 6.77886 7.52378 8.25666 7.16773 numMergedOcc 0
10 mol 60 unq 0 iso 0 dist 8.04921 8.71681 7.55695 12.3408 4.82351 9.90939 numMergedOcc 0
11 mol 92 unq 0 iso 0 dist 8.99661 5.41023 6.61823 8.57012 14.4996 8.91313 numMergedOcc 0
12 mol 92 unq 1 iso 0 dist 8.99661 5.41023 6.61823 9.75945 6.90324 8.16392 numMergedOcc 0
13 mol 98 unq 0 iso 0 dist 7.56041 12.1948 5.88354 14.3375 8.53212 5.59328 numMergedOcc 0
14 mol 98 unq 1 iso 0 dist 7.56041 7.42934 5.74854 14.3375 8.53212 7.5242 numMergedOcc 0
15 mol 100 unq 0 iso 0 dist 8.96048 8.71142 7.12017 15.1918 9.38256 7.38135 numMergedOcc 0
16 mol 119 unq 0 iso 0 dist 9.2746 6.63018 7.99857 13.4131 6.96805 9.11344 numMergedOcc 0
17 mol 119 unq 1 iso 0 dist 9.2746 9.23197 8.56342 13.4131 6.96805 6.52773 numMergedOcc 0
18 mol 119 unq 2 iso 0 dist 9.2746 9.23197 8.56342 12.3107 13.3975 9.23858 numMergedOcc 0
19 mol 141 unq 0 iso 0 dist 6.78772 5.64577 7.86572 6.35397 5.38571 9.97343 numMergedOcc 0
20 mol 148 unq 0 iso 0 dist 9.14135 14.7238 9.74542 16.156 7.23332 9.91993 numMergedOcc 0
21 mol 148 unq 1 iso 0 dist 9.14135 14.7238 9.74542 15.6114 7.89336 6.22055 numMergedOcc 0
22 mol 150 unq 0 iso 0 dist 9.12067 14.7649 9.6606 16.255 7.35366 9.96691 numMergedOcc 0
23 mol 150 unq 1 iso 0 dist 9.12067 14.7649 9.6606 15.6194 7.86976 6.14675 numMergedOcc 0
24 mol 150 unq 2 iso 0 dist 9.12067 14.7649 9.6606 19.6845 11.8012 9.24244 numMergedOcc 0
25 mol 188 unq 0 iso 0 dist 7.98533 6.33907 8.57261 10.1528 5.0782 7.14503 numMergedOcc 0
26 mol 188 unq 1 iso 0 dist 7.98533 6.33907 8.57261 6.1338 5.87427 8.10214 numMergedOcc 0
27 mol 205 unq 0 iso 0 dist 8.01082 9.43922 5.60393 14.5739 8.46033 5.44002 numMergedOcc 0
28 mol 210 unq 0 iso 0 dist 9.76706 7.19612 5.37446 11.9541 7.1777 7.10826 numMergedOcc 0
29 mol 212 unq 0 iso 0 dist 8.27217 7.30329 8.74585 16.0468 15.1535 9.74144 numMergedOcc 0
30 mol 212 unq 1 iso 0 dist 8.27217 7.30329 8.74585 11.23 4.21442 8.69988 numMergedOcc 0
31 mol 212 unq 2 iso 0 dist 8.27217 7.30329 8.74585 11.3299 6.69225 8.55903 numMergedOcc 0
32 mol 212 unq 3 iso 0 dist 8.27217 7.30329 8.74585 12.8189 10.1399 7.15603 numMergedOcc 0
33 mol 238 unq 0 iso 0 dist 6.52129 5.65307 5.52379 8.03226 5.83386 7.10685 numMergedOcc 0
34 mol 278 unq 0 iso 0 dist 6.06813 9.61803 7.67245 16.1228 13.537 6.62841 numMergedOcc 0
