0 mol 11 unq 0 iso 0 dist 5.47299 7.27588 6.83186 6.56599 3.66215 5.25331 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 5.40468 7.16699 6.83186 6.35021 3.56133 4.79838 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 9.03639 9.09595 9.2087 8.69877 5.64409 5.34723 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 8.73053 8.52974 9.48125 6.75771 3.8237 7.69101 numMergedOcc 0
4 mol 34 unq 1 iso 0 dist 8.73053 8.52974 9.48125 11.4317 4.97937 9.57665 numMergedOcc 0
5 mol 34 unq 2 iso 0 dist 7.07087 5.27925 9.48125 5.90246 3.8237 7.69101 numMergedOcc 0
6 mol 34 unq 3 iso 0 dist 7.07087 5.27925 9.48125 9.69279 4.97937 9.57665 numMergedOcc 0
7 mol 48 unq 0 iso 0 dist 9.55284 8.48678 6.5241 15.2056 12.3016 7.16443 numMergedOcc 0
8 mol 48 unq 1 iso 0 dist 7.33788 7.0331 8.96151 10.5396 7.78417 7.03832 numMergedOcc 0
9 mol 48 unq 2 iso 0 dist 7.33788 3.85292 4.22002 10.5396 7.78417 7.16443 numMergedOcc 0
10 mol 48 unq 3 iso 0 dist 9.74351 3.85292 8.10774 10.5396 12.2824 7.16443 numMergedOcc 0
11 mol 48 unq 4 iso 0 dist 7.36877 3.85292 6.5241 10.5396 12.3016 7.16443 numMergedOcc 0
12 mol 48 unq 5 iso 0 dist 8.52681 10.4499 8.96151 10.9142 7.78417 7.03832 numMergedOcc 0
13 mol 48 unq 6 iso 0 dist 8.52681 6.44604 4.22002 10.9142 7.78417 7.16443 numMergedOcc 0
14 mol 48 unq 7 iso 0 dist 9.98769 6.44604 8.10774 10.9142 12.2824 7.16443 numMergedOcc 0
15 mol 48 unq 8 iso 0 dist 9.21776 3.72746 8.14245 10.4168 12.2601 7.08628 numMergedOcc 0
16 mol 48 unq 9 iso 0 dist 6.89752 3.72746 6.36817 10.4168 12.2529 7.08628 numMergedOcc 0
17 mol 48 unq 10 iso 0 dist 6.85843 3.72746 4.17933 10.4168 7.83821 7.08628 numMergedOcc 0
18 mol 48 unq 11 iso 0 dist 9.40291 6.4561 8.14245 10.3969 12.2601 7.08628 numMergedOcc 0
19 mol 48 unq 12 iso 0 dist 7.94814 6.4561 4.17933 10.3969 7.83821 7.08628 numMergedOcc 0
20 mol 48 unq 13 iso 0 dist 9.55632 6.4561 5.54893 10.3969 5.51708 7.08628 numMergedOcc 0
21 mol 76 unq 0 iso 0 dist 9.50939 8.58474 7.66068 16.993 10.865 8.90522 numMergedOcc 0
22 mol 79 unq 0 iso 0 dist 6.64921 4.15002 4.15789 10.0611 4.35906 7.90338 numMergedOcc 0
23 mol 79 unq 1 iso 0 dist 6.64921 9.36535 4.808 10.0611 4.35906 7.08462 numMergedOcc 0
24 mol 101 unq 0 iso 0 dist 8.2549 6.43467 8.19144 14.5188 11.7377 8.35515 numMergedOcc 0
25 mol 141 unq 0 iso 0 dist 5.28634 6.1672 4.88514 6.27859 9.08526 6.50336 numMergedOcc 0
26 mol 176 unq 0 iso 0 dist 9.60931 11.2094 6.85902 15.8142 6.33976 9.67312 numMergedOcc 0
27 mol 193 unq 0 iso 0 dist 9.73679 4.8988 8.30069 9.53066 6.11405 6.17074 numMergedOcc 0
28 mol 254 unq 0 iso 0 dist 9.83135 9.22906 7.85841 13.9815 6.19835 7.23916 numMergedOcc 0
29 mol 254 unq 1 iso 0 dist 9.83135 12.319 9.20109 13.9815 6.19835 6.12653 numMergedOcc 0
30 mol 254 unq 2 iso 0 dist 7.40957 9.72134 9.20109 10.1882 5.67608 6.59989 numMergedOcc 0
31 mol 256 unq 0 iso 0 dist 9.49634 5.16057 5.58222 9.45135 3.89364 5.85613 numMergedOcc 0
32 mol 266 unq 0 iso 0 dist 9.90506 4.39553 6.96692 9.85022 16.2268 9.6721 numMergedOcc 0
33 mol 266 unq 1 iso 0 dist 9.03341 3.94797 6.96692 10.4026 16.2268 9.6721 numMergedOcc 0
34 mol 266 unq 2 iso 0 dist 6.39822 7.63149 8.25286 12.6987 16.7453 9.6721 numMergedOcc 0
35 mol 266 unq 3 iso 0 dist 8.61077 4.39553 8.25286 9.85022 16.7453 9.6721 numMergedOcc 0
36 mol 266 unq 4 iso 0 dist 5.36518 7.63149 9.9965 12.6987 17.4207 9.6721 numMergedOcc 0
37 mol 266 unq 5 iso 0 dist 9.11585 4.39553 9.9965 9.85022 17.4207 9.6721 numMergedOcc 0
38 mol 287 unq 0 iso 0 dist 5.55176 5.13698 4.68668 10.3062 8.99193 5.50067 numMergedOcc 0
39 mol 288 unq 0 iso 0 dist 5.55176 5.13698 4.68668 10.3062 8.99193 5.50067 numMergedOcc 0
40 mol 289 unq 0 iso 0 dist 5.55176 5.13698 4.68668 10.3062 8.99193 5.50067 numMergedOcc 0
