0 mol 15 unq 0 iso 0 dist 8.0637 4.27439 7.42909 7.57076 8.00576 5.82801 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 4.70023 8.5884 10.1522 9.04157 10.7484 4.96019 numMergedOcc 0
2 mol 28 unq 0 iso 0 dist 5.9948 8.24316 8.34712 6.76158 11.7233 11.1346 numMergedOcc 0
3 mol 28 unq 1 iso 0 dist 5.9948 8.24316 8.34712 7.423 13.0183 10.8275 numMergedOcc 0
4 mol 28 unq 2 iso 0 dist 5.9948 8.24316 8.34712 5.89257 10.9699 7.90018 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 7.55854 7.49678 9.90363 9.29102 3.60325 10.1404 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 9.0101 7.52544 7.7047 8.26805 9.68005 5.50078 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 9.0101 7.52544 7.7047 9.68577 14.6547 11.6055 numMergedOcc 0
8 mol 76 unq 2 iso 0 dist 9.0101 8.08674 4.00834 8.26805 9.68005 11.6853 numMergedOcc 0
9 mol 76 unq 3 iso 0 dist 9.0101 8.08674 4.00834 9.68577 14.6547 15.0489 numMergedOcc 0
10 mol 76 unq 4 iso 0 dist 9.0101 8.33694 9.6911 8.26805 9.68005 4.94673 numMergedOcc 0
11 mol 76 unq 5 iso 0 dist 9.0101 8.33694 9.6911 9.68577 14.6547 5.78236 numMergedOcc 0
12 mol 81 unq 0 iso 0 dist 6.03428 5.14604 5.39514 7.94697 7.93947 4.95944 numMergedOcc 0
13 mol 88 unq 0 iso 0 dist 9.79535 9.75856 5.53481 9.57352 14.0189 14.3183 numMergedOcc 0
14 mol 88 unq 1 iso 0 dist 7.33521 9.75856 14.384 9.57352 6.41397 14.3183 numMergedOcc 0
15 mol 90 unq 0 iso 0 dist 8.91055 8.60438 4.59148 7.30934 7.8463 4.77556 numMergedOcc 0
16 mol 98 unq 0 iso 0 dist 6.31509 9.74889 6.99582 5.91023 4.48773 7.22521 numMergedOcc 0
17 mol 98 unq 1 iso 0 dist 6.14782 9.74889 10.1149 5.91023 3.8493 7.22521 numMergedOcc 0
18 mol 98 unq 2 iso 0 dist 8.49806 9.74889 4.34199 5.91023 3.78499 7.22521 numMergedOcc 0
19 mol 103 unq 0 iso 0 dist 8.8763 8.84955 14.6504 7.91691 13.4361 6.01221 numMergedOcc 0
20 mol 114 unq 0 iso 0 dist 5.99873 8.80616 4.66388 8.18193 6.83136 4.5348 numMergedOcc 0
21 mol 114 unq 1 iso 0 dist 5.99873 8.25015 12.5061 8.18193 6.83136 15.571 numMergedOcc 0
22 mol 168 unq 0 iso 0 dist 8.80094 8.66519 16.2482 8.47439 15.207 12.949 numMergedOcc 0
23 mol 168 unq 1 iso 0 dist 9.03681 8.66519 5.21399 8.47439 10.3454 12.949 numMergedOcc 0
24 mol 260 unq 0 iso 0 dist 8.79012 5.16772 13.9264 7.13397 3.48905 11.9315 numMergedOcc 0
25 mol 260 unq 1 iso 0 dist 8.79012 5.16772 13.9264 5.33278 8.84611 8.79837 numMergedOcc 0
26 mol 266 unq 0 iso 0 dist 9.477 9.51286 5.54798 6.9943 3.87565 5.79323 numMergedOcc 0
27 mol 266 unq 1 iso 0 dist 9.477 9.51286 5.54798 7.36685 9.25882 7.52317 numMergedOcc 0
28 mol 266 unq 2 iso 0 dist 9.477 9.51286 5.54798 9.03099 12.1357 9.52953 numMergedOcc 0
