0 mol 24 unq 0 iso 0 dist 7.63824 11.6096 5.9372 8.12171 4.11146 5.95834 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 7.63824 10.8208 6.93597 8.12171 4.11146 4.2121 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 9.7649 16.5248 7.85986 21.7504 12.2839 6.72323 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 6.5268 13.7733 7.85986 18.8006 12.2839 6.72323 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 7.0851 6.26554 6.53981 11.7324 8.06674 7.48846 numMergedOcc 0
5 mol 55 unq 0 iso 0 dist 9.2397 4.31691 6.76315 11.914 3.56023 9.93096 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 6.29267 6.0425 6.2576 10.2613 6.07693 8.03296 numMergedOcc 0
7 mol 79 unq 1 iso 0 dist 6.29267 6.0425 6.2576 11.3221 5.25584 9.26979 numMergedOcc 0
8 mol 79 unq 2 iso 0 dist 6.29267 11.8739 8.96069 10.2613 6.07693 5.82754 numMergedOcc 0
9 mol 79 unq 3 iso 0 dist 6.29267 11.8739 8.96069 11.3221 5.25584 9.05679 numMergedOcc 0
10 mol 79 unq 4 iso 0 dist 6.29267 11.9735 7.56495 18.931 13.2204 9.78384 numMergedOcc 0
11 mol 79 unq 5 iso 0 dist 6.29267 11.9735 7.56495 10.2613 6.07693 8.87742 numMergedOcc 0
12 mol 79 unq 6 iso 0 dist 6.29267 11.9735 7.56495 11.3221 5.25584 4.93468 numMergedOcc 0
13 mol 85 unq 0 iso 0 dist 8.15861 4.32784 8.04853 5.99046 11.3242 9.66222 numMergedOcc 0
14 mol 91 unq 0 iso 0 dist 7.09177 5.75219 9.97813 4.86532 5.21888 8.66165 numMergedOcc 0
15 mol 93 unq 0 iso 0 dist 8.92653 6.87756 5.56839 12.3507 5.90646 8.74378 numMergedOcc 0
16 mol 93 unq 1 iso 0 dist 8.92653 5.82092 7.83506 12.3507 5.90646 8.89417 numMergedOcc 0
17 mol 93 unq 2 iso 0 dist 8.92653 5.82092 7.83506 15.7026 12.949 9.95255 numMergedOcc 0
18 mol 129 unq 0 iso 0 dist 8.42277 10.1785 8.98175 15.9323 9.06432 9.73158 numMergedOcc 0
19 mol 129 unq 1 iso 0 dist 8.42277 10.1785 8.98175 15.5396 11.2951 7.59327 numMergedOcc 0
20 mol 141 unq 0 iso 0 dist 8.14978 12.0582 9.59109 10.6158 3.80087 9.83945 numMergedOcc 0
21 mol 141 unq 1 iso 0 dist 8.14978 12.0582 9.59109 6.93424 3.80763 6.75376 numMergedOcc 0
22 mol 141 unq 2 iso 0 dist 8.14978 12.0582 9.59109 6.8891 9.98068 9.10042 numMergedOcc 0
23 mol 184 unq 0 iso 0 dist 8.73302 13.8418 7.02762 9.13228 4.12242 7.54099 numMergedOcc 0
24 mol 186 unq 0 iso 0 dist 8.78251 12.5102 5.25762 13.8905 5.39534 6.21159 numMergedOcc 0
25 mol 256 unq 0 iso 0 dist 4.65358 7.49849 9.23909 7.36908 7.27053 4.98734 numMergedOcc 0
26 mol 256 unq 1 iso 0 dist 4.65358 7.49849 9.23909 5.2801 4.26681 6.33496 numMergedOcc 0
27 mol 256 unq 2 iso 0 dist 4.65358 5.91322 9.16597 5.2801 4.26681 7.81448 numMergedOcc 0
28 mol 266 unq 0 iso 0 dist 9.2684 6.33919 7.63543 10.358 4.72338 7.00243 numMergedOcc 0
29 mol 280 unq 0 iso 0 dist 8.6212 6.47507 9.47429 10.2233 8.71368 6.73712 numMergedOcc 0
30 mol 284 unq 0 iso 0 dist 5.2862 9.28495 7.74874 13.6175 9.94624 7.34931 numMergedOcc 0
31 mol 284 unq 1 iso 0 dist 5.31097 7.85427 7.74874 13.2942 9.94624 7.34931 numMergedOcc 0
32 mol 287 unq 0 iso 0 dist 9.03468 5.87907 9.23152 10.0038 5.9468 6.95912 numMergedOcc 0
33 mol 287 unq 1 iso 0 dist 6.05363 14.8133 9.23152 11.8219 5.9468 6.95912 numMergedOcc 0
34 mol 288 unq 0 iso 0 dist 9.03468 5.87907 9.23152 10.0038 5.9468 6.95912 numMergedOcc 0
35 mol 288 unq 1 iso 0 dist 6.05363 14.8133 9.23152 11.8219 5.9468 6.95912 numMergedOcc 0
36 mol 289 unq 0 iso 0 dist 9.03468 5.87907 9.23152 10.0038 5.9468 6.95912 numMergedOcc 0
37 mol 289 unq 1 iso 0 dist 6.05363 14.8133 9.23152 11.8219 5.9468 6.95912 numMergedOcc 0
