0 mol 17 unq 0 iso 0 dist 8.19749 9.52568 7.11364 9.99682 8.15305 10.2 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 8.19749 9.52568 7.11364 9.38298 14.049 9.4204 numMergedOcc 0
2 mol 17 unq 2 iso 0 dist 8.19749 9.15735 8.06983 9.99682 8.15305 6.57693 numMergedOcc 0
3 mol 17 unq 3 iso 0 dist 8.19749 9.15735 8.06983 9.38298 14.049 17.5895 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 9.58408 9.26742 11.8097 7.03345 10.9517 15.4162 numMergedOcc 0
5 mol 25 unq 1 iso 0 dist 9.58408 9.26742 11.8097 5.2296 6.07834 12.1495 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 7.15006 8.90417 4.19771 9.05293 5.46484 9.59932 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 3.90209 8.01128 7.62019 7.40481 10.386 7.89992 numMergedOcc 0
8 mol 132 unq 0 iso 0 dist 6.13054 9.4827 4.90131 6.71787 4.88005 9.50212 numMergedOcc 0
9 mol 132 unq 1 iso 0 dist 6.13054 9.0788 13.8244 6.71787 4.88005 10.8474 numMergedOcc 0
10 mol 154 unq 0 iso 0 dist 9.3164 5.67578 5.21599 8.99568 10.627 8.74561 numMergedOcc 0
11 mol 192 unq 0 iso 0 dist 9.41747 6.04508 9.81428 9.96128 8.02909 10.2291 numMergedOcc 0
12 mol 192 unq 1 iso 0 dist 9.41747 6.04508 9.81428 6.69338 12.357 5.67211 numMergedOcc 0
13 mol 192 unq 2 iso 0 dist 9.41747 6.73104 6.38465 9.96128 8.02909 10.9449 numMergedOcc 0
14 mol 192 unq 3 iso 0 dist 9.41747 6.73104 6.38465 6.69338 12.357 10.0412 numMergedOcc 0
15 mol 213 unq 0 iso 0 dist 6.07688 8.10832 11.0014 4.85533 8.39486 5.52017 numMergedOcc 0
16 mol 228 unq 0 iso 0 dist 9.87391 9.89425 13.6349 8.27678 10.3267 12.6358 numMergedOcc 0
17 mol 228 unq 1 iso 0 dist 8.5499 9.51962 4.53393 9.33596 9.40554 12.5596 numMergedOcc 0
18 mol 228 unq 2 iso 0 dist 9.72673 9.89425 4.60407 8.27678 9.46822 12.6358 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 6.84692 8.6416 8.65126 7.95378 4.56036 6.78632 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 7.77703 6.6688 8.90216 9.64956 11.9007 11.0025 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 9.65416 8.2905 8.97791 8.36667 11.9196 5.0671 numMergedOcc 0
22 mol 279 unq 1 iso 0 dist 9.65416 8.2905 8.97791 6.74021 8.87149 6.42071 numMergedOcc 0
23 mol 279 unq 2 iso 0 dist 9.65416 9.47256 12.6754 8.36667 11.9196 7.96104 numMergedOcc 0
24 mol 279 unq 3 iso 0 dist 9.65416 9.47256 12.6754 6.74021 8.87149 5.75891 numMergedOcc 0
