0 mol 9 unq 0 iso 0 dist 7.25179 6.62605 6.85412 8.90391 9.62394 4.45625 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 7.25179 4.75933 6.33889 8.90391 9.62394 6.0397 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 8.72522 11.0121 6.85412 12.2488 9.62394 4.45625 numMergedOcc 0
3 mol 9 unq 3 iso 0 dist 8.72522 6.35665 6.33889 12.2488 9.62394 6.0397 numMergedOcc 0
4 mol 21 unq 0 iso 0 dist 8.38921 6.86154 6.08338 6.25842 9.06424 10.2036 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 8.13365 10.7829 9.75144 7.1011 7.33768 5.90981 numMergedOcc 0
6 mol 24 unq 1 iso 0 dist 8.13365 10.7829 9.75144 10.8208 9.01567 13.2265 numMergedOcc 0
7 mol 24 unq 2 iso 0 dist 8.13365 10.7829 9.75144 13.3998 7.29868 13.719 numMergedOcc 0
8 mol 43 unq 0 iso 0 dist 8.47617 10.7814 9.83618 12.8271 8.95682 4.54282 numMergedOcc 0
9 mol 54 unq 0 iso 0 dist 6.13476 6.2425 5.02241 9.53962 7.21717 11.0681 numMergedOcc 0
10 mol 156 unq 0 iso 0 dist 9.25604 5.5355 6.88137 11.2214 8.73722 5.69209 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 9.50454 10.9336 6.93764 6.15536 5.9176 5.60306 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 9.50454 10.9336 6.93764 14.7795 6.41453 6.05477 numMergedOcc 0
13 mol 181 unq 2 iso 0 dist 7.15963 9.09192 6.94688 10.5886 8.90963 4.43678 numMergedOcc 0
14 mol 181 unq 3 iso 0 dist 7.15963 12.1848 6.71012 10.5886 8.90963 6.03415 numMergedOcc 0
15 mol 181 unq 4 iso 0 dist 6.43406 4.56814 4.93785 11.4522 9.39829 7.30555 numMergedOcc 0
16 mol 181 unq 5 iso 0 dist 8.80581 5.98221 6.93764 10.5065 5.9176 5.60306 numMergedOcc 0
17 mol 181 unq 6 iso 0 dist 8.80581 5.98221 6.93764 6.04759 6.41453 6.05477 numMergedOcc 0
18 mol 197 unq 0 iso 0 dist 9.14737 7.69844 8.99696 14.372 7.50013 11.1666 numMergedOcc 0
19 mol 197 unq 1 iso 0 dist 9.14737 7.69844 8.99696 14.6749 5.81233 13.3562 numMergedOcc 0
20 mol 197 unq 2 iso 0 dist 9.14737 7.69844 8.99696 5.9589 6.92924 4.59269 numMergedOcc 0
21 mol 197 unq 3 iso 0 dist 9.14737 7.69844 8.99696 9.27427 7.14306 12.9766 numMergedOcc 0
22 mol 197 unq 4 iso 0 dist 9.14737 15.0242 7.85058 14.372 7.50013 5.53129 numMergedOcc 0
23 mol 197 unq 5 iso 0 dist 9.14737 15.0242 7.85058 14.6749 5.81233 4.38296 numMergedOcc 0
24 mol 197 unq 6 iso 0 dist 9.14737 15.0242 7.85058 5.9589 6.92924 11.3267 numMergedOcc 0
25 mol 197 unq 7 iso 0 dist 9.14737 15.0242 7.85058 9.27427 7.14306 8.05362 numMergedOcc 0
26 mol 197 unq 8 iso 0 dist 9.14737 12.1399 9.96638 14.372 7.50013 6.46195 numMergedOcc 0
27 mol 197 unq 9 iso 0 dist 9.14737 12.1399 9.96638 14.6749 5.81233 11.0356 numMergedOcc 0
28 mol 197 unq 10 iso 0 dist 9.14737 12.1399 9.96638 5.9589 6.92924 6.31157 numMergedOcc 0
29 mol 197 unq 11 iso 0 dist 9.14737 12.1399 9.96638 9.27427 7.14306 11.5276 numMergedOcc 0
30 mol 204 unq 0 iso 0 dist 6.20646 6.27504 5.90931 11.1093 9.68728 11.145 numMergedOcc 0
31 mol 204 unq 1 iso 0 dist 6.73266 6.67807 5.90931 5.39256 9.68728 11.145 numMergedOcc 0
32 mol 213 unq 0 iso 0 dist 7.22234 10.6066 6.0965 6.51731 7.37798 6.17282 numMergedOcc 0
33 mol 213 unq 1 iso 0 dist 7.22234 10.6066 6.0965 12.2528 7.73322 10.5013 numMergedOcc 0
34 mol 213 unq 2 iso 0 dist 7.22234 15.6607 9.59129 6.51731 7.37798 12.1116 numMergedOcc 0
35 mol 213 unq 3 iso 0 dist 7.22234 15.6607 9.59129 12.2528 7.73322 9.93085 numMergedOcc 0
36 mol 213 unq 4 iso 0 dist 5.86501 5.56276 6.0965 4.40169 7.37798 6.17282 numMergedOcc 0
37 mol 213 unq 5 iso 0 dist 5.86501 5.56276 6.0965 9.42696 7.73322 10.5013 numMergedOcc 0
38 mol 213 unq 6 iso 0 dist 5.86501 10.1617 9.59129 4.40169 7.37798 12.1116 numMergedOcc 0
39 mol 213 unq 7 iso 0 dist 5.86501 10.1617 9.59129 9.42696 7.73322 9.93085 numMergedOcc 0
40 mol 234 unq 0 iso 0 dist 6.15754 4.48571 6.25105 14.7836 9.81425 13.0631 numMergedOcc 0
41 mol 234 unq 1 iso 0 dist 6.6281 5.91466 6.25105 10.5885 9.81425 13.0631 numMergedOcc 0
42 mol 235 unq 0 iso 0 dist 8.84872 13.4086 9.58736 9.6662 9.55668 13.128 numMergedOcc 0
43 mol 238 unq 0 iso 0 dist 6.51823 9.28896 6.77463 12.1252 8.67864 4.38002 numMergedOcc 0
44 mol 238 unq 1 iso 0 dist 6.51823 6.04481 7.2766 12.1252 8.67864 11.5793 numMergedOcc 0
45 mol 240 unq 0 iso 0 dist 7.0935 6.65921 6.15305 12.7219 6.68687 9.66581 numMergedOcc 0
46 mol 240 unq 1 iso 0 dist 7.0935 10.6145 8.0951 12.7219 6.68687 7.03039 numMergedOcc 0
47 mol 284 unq 0 iso 0 dist 9.12551 10.7029 4.86729 9.83671 6.78191 6.76453 numMergedOcc 0
48 mol 292 unq 0 iso 0 dist 8.99442 3.91335 9.454 8.70711 7.83341 6.93991 numMergedOcc 0
