0 mol 26 unq 0 iso 0 dist 5.20647 7.12852 9.73258 5.95398 5.73363 11.0406 numMergedOcc 0
1 mol 33 unq 0 iso 0 dist 5.32407 8.52627 8.17675 6.72942 6.42569 9.85464 numMergedOcc 0
2 mol 33 unq 1 iso 0 dist 6.53102 8.52627 5.82516 6.72942 9.13872 9.85464 numMergedOcc 0
3 mol 33 unq 2 iso 0 dist 7.76575 8.52627 4.87306 6.72942 7.27307 9.85464 numMergedOcc 0
4 mol 33 unq 3 iso 0 dist 9.74394 8.52627 7.1347 6.72942 5.73206 9.85464 numMergedOcc 0
5 mol 122 unq 0 iso 0 dist 8.3907 9.55337 5.73775 14.6893 9.62551 15.2504 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 5.63173 9.59094 6.2062 4.42593 5.84909 7.46812 numMergedOcc 0
7 mol 141 unq 0 iso 0 dist 6.74947 9.55297 15.8344 12.8281 8.52591 20.0394 numMergedOcc 0
8 mol 141 unq 1 iso 0 dist 6.74947 7.447 5.25586 12.8281 8.52591 13.7226 numMergedOcc 0
9 mol 141 unq 2 iso 0 dist 6.74947 6.59782 10.1908 12.8281 8.52591 18.1503 numMergedOcc 0
10 mol 197 unq 0 iso 0 dist 8.22331 6.58245 4.40086 4.80458 7.32228 8.4273 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 8.95136 6.37411 15.2718 10.5621 9.44038 15.1934 numMergedOcc 0
12 mol 212 unq 0 iso 0 dist 7.11204 6.11919 6.91212 9.56548 9.25225 13.8022 numMergedOcc 0
13 mol 233 unq 0 iso 0 dist 8.36772 5.34745 8.95188 4.62851 9.72186 7.6416 numMergedOcc 0
14 mol 233 unq 1 iso 0 dist 8.83541 5.34745 5.19341 4.62851 8.39315 7.6416 numMergedOcc 0
15 mol 233 unq 2 iso 0 dist 7.55878 5.34745 5.3674 14.8036 8.01777 12.0539 numMergedOcc 0
16 mol 233 unq 3 iso 0 dist 4.91191 7.99897 5.3674 4.26152 8.01777 12.0539 numMergedOcc 0
17 mol 233 unq 4 iso 0 dist 7.89581 8.98366 5.19341 9.98649 8.39315 7.6416 numMergedOcc 0
18 mol 236 unq 0 iso 0 dist 6.54859 7.05868 4.52208 7.3073 6.94194 10.8605 numMergedOcc 0
19 mol 247 unq 0 iso 0 dist 6.35578 6.34304 4.32191 10.9079 9.75065 13.168 numMergedOcc 0
20 mol 260 unq 0 iso 0 dist 7.90537 9.50619 5.51525 7.80956 9.54363 9.90354 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 6.58667 9.28545 13.5948 9.78665 8.99435 18.9689 numMergedOcc 0
