0 mol 9 unq 0 iso 0 dist 7.25179 6.62605 6.85412 10.8001 5.60154 9.29529 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 7.25179 4.75933 6.33889 10.8001 5.60154 7.2199 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 7.25179 4.75933 6.33889 7.95202 4.61049 6.9513 numMergedOcc 0
3 mol 9 unq 3 iso 0 dist 7.25179 4.75933 6.33889 6.75249 6.64015 9.16116 numMergedOcc 0
4 mol 9 unq 4 iso 0 dist 7.25179 4.75933 6.33889 12.4057 13.7377 8.47109 numMergedOcc 0
5 mol 9 unq 5 iso 0 dist 8.72522 11.0121 6.85412 10.7994 5.60154 9.29529 numMergedOcc 0
6 mol 9 unq 6 iso 0 dist 8.72522 6.35665 6.33889 10.7994 5.60154 7.2199 numMergedOcc 0
7 mol 9 unq 7 iso 0 dist 8.72522 6.35665 6.33889 6.21942 4.61049 6.9513 numMergedOcc 0
8 mol 9 unq 8 iso 0 dist 8.72522 6.35665 6.33889 6.38082 6.64015 9.16116 numMergedOcc 0
9 mol 9 unq 9 iso 0 dist 8.72522 6.35665 6.33889 11.266 13.7377 8.47109 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 5.11612 5.39389 7.76729 9.36283 6.34759 7.99631 numMergedOcc 0
11 mol 115 unq 1 iso 0 dist 5.11612 5.39389 7.76729 9.95565 10.2377 6.40036 numMergedOcc 0
12 mol 115 unq 2 iso 0 dist 5.22628 5.26498 7.64585 10.2245 10.7942 6.40036 numMergedOcc 0
13 mol 127 unq 0 iso 0 dist 8.09965 9.46933 8.59981 10.4013 4.77464 6.3244 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 8.94909 11.1266 7.92688 17.079 11.8989 9.94276 numMergedOcc 0
15 mol 133 unq 1 iso 0 dist 8.94909 11.1266 7.92688 17.4115 15.0734 9.05357 numMergedOcc 0
16 mol 133 unq 2 iso 0 dist 8.94909 11.1266 7.92688 15.9998 9.58627 5.99299 numMergedOcc 0
17 mol 134 unq 0 iso 0 dist 8.75736 9.88404 8.94837 10.996 5.9915 6.4218 numMergedOcc 0
18 mol 134 unq 1 iso 0 dist 6.76166 6.15672 8.94837 6.33375 5.9915 6.4218 numMergedOcc 0
19 mol 134 unq 2 iso 0 dist 6.32178 9.88404 7.77454 10.996 10.7186 6.4218 numMergedOcc 0
20 mol 134 unq 3 iso 0 dist 7.2977 6.15672 7.77454 6.33375 10.7186 6.4218 numMergedOcc 0
21 mol 173 unq 0 iso 0 dist 9.09857 9.00192 8.31897 18.6245 14.2537 9.79554 numMergedOcc 0
22 mol 175 unq 0 iso 0 dist 7.94593 11.0605 9.31887 13.2601 8.22779 4.79852 numMergedOcc 0
23 mol 181 unq 0 iso 0 dist 7.15963 9.09192 6.94688 7.82604 8.25067 8.20656 numMergedOcc 0
24 mol 181 unq 1 iso 0 dist 7.15963 12.1848 6.71012 7.82604 8.25067 9.40622 numMergedOcc 0
25 mol 213 unq 0 iso 0 dist 7.22234 15.6607 9.59129 19.151 12.2579 8.74171 numMergedOcc 0
26 mol 213 unq 1 iso 0 dist 5.86501 10.1617 9.59129 15.5792 12.2579 8.74171 numMergedOcc 0
27 mol 213 unq 2 iso 0 dist 9.1663 11.5478 6.68292 18.9522 11.1063 8.74171 numMergedOcc 0
28 mol 213 unq 3 iso 0 dist 9.1663 11.5478 6.68292 12.6618 4.93472 6.85195 numMergedOcc 0
29 mol 213 unq 4 iso 0 dist 9.1663 7.28957 4.26212 12.6618 4.93472 6.17451 numMergedOcc 0
30 mol 218 unq 0 iso 0 dist 9.85348 7.64323 8.53199 13.0683 7.47048 6.75035 numMergedOcc 0
31 mol 224 unq 0 iso 0 dist 9.61379 4.53973 7.06793 11.9527 7.98696 8.89778 numMergedOcc 0
32 mol 224 unq 1 iso 0 dist 9.61379 5.98813 6.67585 11.9527 7.98696 9.47554 numMergedOcc 0
33 mol 234 unq 0 iso 0 dist 8.9413 6.40261 9.5707 10.7835 5.56749 8.49841 numMergedOcc 0
34 mol 234 unq 1 iso 0 dist 8.9413 6.40261 9.5707 14.5137 12.1076 9.6101 numMergedOcc 0
35 mol 234 unq 2 iso 0 dist 4.91961 12.2893 9.5707 6.553 5.56749 8.49841 numMergedOcc 0
36 mol 234 unq 3 iso 0 dist 4.91961 12.2893 9.5707 10.8407 12.1076 9.6101 numMergedOcc 0
37 mol 234 unq 4 iso 0 dist 7.14333 10.3017 9.39181 10.8407 6.29366 5.32183 numMergedOcc 0
38 mol 238 unq 0 iso 0 dist 6.51823 9.28896 6.77463 10.8792 4.87097 6.00721 numMergedOcc 0
39 mol 243 unq 0 iso 0 dist 9.39147 11.562 8.61104 11.9271 6.55284 9.1101 numMergedOcc 0
40 mol 243 unq 1 iso 0 dist 9.39147 11.562 8.61104 17.8498 10.5389 8.93338 numMergedOcc 0
41 mol 243 unq 2 iso 0 dist 7.70059 7.2163 8.61104 11.1426 6.55284 9.1101 numMergedOcc 0
42 mol 243 unq 3 iso 0 dist 7.70059 7.2163 8.61104 14.7141 10.5389 8.93338 numMergedOcc 0
43 mol 259 unq 0 iso 0 dist 8.69345 13.2072 7.50578 16.7652 11.5772 8.76313 numMergedOcc 0
44 mol 259 unq 1 iso 0 dist 8.69345 13.2072 7.50578 15.0852 7.44916 7.4363 numMergedOcc 0
