0 mol 25 unq 0 iso 0 dist 4.71964 6.44262 7.6114 5.46378 7.1845 7.685 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 8.33273 5.27705 7.26268 10.0999 5.57199 8.68559 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 5.40287 9.02602 8.69057 13.773 11.0945 6.40841 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 8.76815 5.4779 7.39665 12.498 7.39155 7.96497 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 8.85892 11.4473 8.72682 16.846 10.1413 7.13087 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 9.54537 14.437 7.51139 15.1793 8.40245 9.10189 numMergedOcc 0
6 mol 88 unq 1 iso 0 dist 9.54537 4.31214 7.80898 9.97598 7.15936 8.66514 numMergedOcc 0
7 mol 88 unq 2 iso 0 dist 9.54537 4.31214 7.80898 10.9704 10.8763 9.25235 numMergedOcc 0
8 mol 89 unq 0 iso 0 dist 8.54514 7.8379 5.51831 13.7036 8.44919 8.75946 numMergedOcc 0
9 mol 117 unq 0 iso 0 dist 8.15473 10.0436 8.19331 12.7737 5.56883 7.63616 numMergedOcc 0
10 mol 142 unq 0 iso 0 dist 9.64785 12.444 7.81207 14.3906 5.26247 7.15475 numMergedOcc 0
11 mol 142 unq 1 iso 0 dist 9.64785 7.18287 6.14151 14.3906 5.26247 9.07935 numMergedOcc 0
12 mol 224 unq 0 iso 0 dist 8.55819 10.5504 8.79428 15.789 10.9705 6.65984 numMergedOcc 0
13 mol 225 unq 0 iso 0 dist 6.20862 4.72643 8.1945 4.90724 3.92979 5.50387 numMergedOcc 0
14 mol 225 unq 1 iso 0 dist 7.27888 15.1562 8.1945 11.0795 3.92979 5.50387 numMergedOcc 0
15 mol 257 unq 0 iso 0 dist 8.76085 9.4018 8.83833 14.8103 10.0311 7.14834 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 9.93282 15.3167 6.9899 19.0218 9.2872 6.77938 numMergedOcc 0
17 mol 259 unq 1 iso 0 dist 9.93282 15.3167 6.9899 14.0593 4.61451 7.76676 numMergedOcc 0
18 mol 259 unq 2 iso 0 dist 6.93417 5.07898 7.66153 9.19369 14.0829 7.48005 numMergedOcc 0
