0 mol 61 unq 0 iso 0 dist 9.2228 6.94677 5.04866 8.42799 12.841 9.25641 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 9.82294 6.23138 8.95689 4.96726 9.21546 9.97159 numMergedOcc 0
2 mol 109 unq 0 iso 0 dist 9.82647 9.53055 6.25986 6.78736 9.64641 6.60933 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 9.73038 6.72323 12.9623 10.2385 15.8406 6.16242 numMergedOcc 0
4 mol 133 unq 1 iso 0 dist 9.73038 6.72323 12.9623 4.64588 13.9771 5.87634 numMergedOcc 0
5 mol 133 unq 2 iso 0 dist 5.84909 7.31633 5.10826 5.36939 9.1146 7.56378 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 9.73865 6.78469 7.22151 6.4437 11.6655 9.87644 numMergedOcc 0
7 mol 141 unq 1 iso 0 dist 8.52591 8.01453 7.22151 5.91683 11.6655 9.87644 numMergedOcc 0
8 mol 163 unq 0 iso 0 dist 9.24754 9.62943 3.7064 4.12904 8.32426 9.07943 numMergedOcc 0
9 mol 170 unq 0 iso 0 dist 9.05865 9.53158 4.11212 8.89464 11.0677 9.10511 numMergedOcc 0
10 mol 170 unq 1 iso 0 dist 9.05865 9.53158 4.11212 7.71028 9.32245 6.35982 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 8.90161 5.97968 5.51195 9.09989 10.6064 8.90963 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 7.11262 8.50382 5.51195 12.4243 10.6064 8.90963 numMergedOcc 0
13 mol 181 unq 2 iso 0 dist 6.60648 9.07527 12.2278 9.32503 13.3327 5.9176 numMergedOcc 0
14 mol 205 unq 0 iso 0 dist 5.81277 5.86419 5.00854 4.78067 6.23932 4.8668 numMergedOcc 0
15 mol 205 unq 1 iso 0 dist 9.85777 7.23557 10.0824 4.2475 6.94789 4.8668 numMergedOcc 0
16 mol 205 unq 2 iso 0 dist 8.47833 7.23557 11.1448 4.2475 11.2748 4.8668 numMergedOcc 0
17 mol 205 unq 3 iso 0 dist 5.05912 7.23557 5.00854 4.2475 6.23932 4.8668 numMergedOcc 0
18 mol 205 unq 4 iso 0 dist 5.47586 8.86587 11.1448 6.8901 11.2748 4.8668 numMergedOcc 0
19 mol 205 unq 5 iso 0 dist 6.60429 8.86587 5.00854 6.8901 6.23932 4.8668 numMergedOcc 0
20 mol 222 unq 0 iso 0 dist 4.87053 5.89818 4.07008 4.82768 8.86173 7.67576 numMergedOcc 0
21 mol 222 unq 1 iso 0 dist 4.87053 9.32543 10.3765 4.82768 8.86173 9.82371 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 9.91128 7.26887 4.04422 4.39639 11.4073 8.94014 numMergedOcc 0
23 mol 238 unq 1 iso 0 dist 9.91128 7.26887 4.04422 6.57364 10.6583 7.02333 numMergedOcc 0
24 mol 238 unq 2 iso 0 dist 9.91128 7.26887 4.04422 10.9854 11.147 8.67864 numMergedOcc 0
25 mol 287 unq 0 iso 0 dist 9.38187 8.42076 5.1517 8.60619 10.3838 6.89451 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 9.38187 8.42076 5.1517 8.60619 10.3838 6.89451 numMergedOcc 0
27 mol 289 unq 0 iso 0 dist 9.38187 8.42076 5.1517 8.60619 10.3838 6.89451 numMergedOcc 0
