0 mol 11 unq 0 iso 0 dist 5.96346 6.84216 6.76736 8.05213 8.73067 4.79838 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 4.30695 8.01262 6.03873 7.27724 7.56871 5.67087 numMergedOcc 0
2 mol 11 unq 2 iso 0 dist 4.30695 6.58046 8.84131 7.85924 11.7385 5.25331 numMergedOcc 0
3 mol 11 unq 3 iso 0 dist 6.35398 8.01262 12.9584 7.27724 12.9286 5.67087 numMergedOcc 0
4 mol 11 unq 4 iso 0 dist 6.35398 6.58046 6.51674 7.85924 9.09091 5.25331 numMergedOcc 0
5 mol 19 unq 0 iso 0 dist 6.41423 7.7312 5.31883 4.69858 5.82366 6.38574 numMergedOcc 0
6 mol 32 unq 0 iso 0 dist 7.99969 8.91596 10.8132 7.93694 11.9741 5.9972 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 9.92355 9.23438 8.76454 5.92889 13.7654 8.98478 numMergedOcc 0
8 mol 58 unq 1 iso 0 dist 7.68678 7.17488 8.76454 7.05413 13.7654 8.98478 numMergedOcc 0
9 mol 75 unq 0 iso 0 dist 9.81166 9.16597 7.98253 10.0425 13.1026 7.30467 numMergedOcc 0
10 mol 102 unq 0 iso 0 dist 8.31932 5.54256 7.28191 5.498 13.2332 7.68537 numMergedOcc 0
11 mol 114 unq 0 iso 0 dist 6.84011 9.93438 5.99273 9.2907 10.1333 9.26486 numMergedOcc 0
12 mol 114 unq 1 iso 0 dist 6.84011 9.93438 5.99273 8.88748 5.79343 7.93956 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 9.87644 9.3273 5.16197 4.29204 8.00449 9.68074 numMergedOcc 0
14 mol 143 unq 0 iso 0 dist 7.78652 8.99891 14.3396 5.44503 13.204 8.08798 numMergedOcc 0
15 mol 143 unq 1 iso 0 dist 8.91301 8.99891 12.476 5.44503 13.8861 8.08798 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 6.22122 9.70481 13.4378 5.88819 7.13252 7.61421 numMergedOcc 0
17 mol 181 unq 1 iso 0 dist 5.94469 8.29467 3.63671 6.7991 7.05653 6.91878 numMergedOcc 0
18 mol 218 unq 0 iso 0 dist 6.1951 6.09255 3.83106 4.54272 10.506 9.39609 numMergedOcc 0
19 mol 235 unq 0 iso 0 dist 9.55668 8.08965 6.82702 4.65302 7.95766 9.11149 numMergedOcc 0
20 mol 237 unq 0 iso 0 dist 7.41478 9.7255 4.50383 6.56344 5.98039 8.33629 numMergedOcc 0
21 mol 237 unq 1 iso 0 dist 9.20822 9.7255 12.5736 6.56344 11.5576 8.33629 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 8.91712 9.18744 3.96271 4.62998 5.59555 7.77225 numMergedOcc 0
23 mol 287 unq 1 iso 0 dist 9.65934 5.30118 5.39801 7.23534 5.59555 5.50067 numMergedOcc 0
24 mol 288 unq 0 iso 0 dist 8.91712 9.18744 3.96271 4.62998 5.59555 7.77225 numMergedOcc 0
25 mol 288 unq 1 iso 0 dist 9.65934 5.30118 5.39801 7.23534 5.59555 5.50067 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 8.91712 9.18744 3.96271 4.62998 5.59555 7.77225 numMergedOcc 0
27 mol 289 unq 1 iso 0 dist 9.65934 5.30118 5.39801 7.23534 5.59555 5.50067 numMergedOcc 0
28 mol 292 unq 0 iso 0 dist 8.87028 9.96374 8.33171 12.1551 11.7643 3.93401 numMergedOcc 0
