0 mol 4 unq 0 iso 0 dist 9.4539 5.30385 7.87155 6.97734 3.9877 5.39676 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 9.4539 9.77024 12.4212 6.97734 3.9877 12.9411 numMergedOcc 0
2 mol 4 unq 2 iso 0 dist 6.47964 5.30385 8.55937 6.97734 12.1304 5.39676 numMergedOcc 0
3 mol 4 unq 3 iso 0 dist 6.47964 9.77024 5.48752 6.97734 12.1304 12.9411 numMergedOcc 0
4 mol 4 unq 4 iso 0 dist 9.50144 5.30385 11.5141 6.97734 15.8209 5.39676 numMergedOcc 0
5 mol 4 unq 5 iso 0 dist 9.50144 9.77024 10.0111 6.97734 15.8209 12.9411 numMergedOcc 0
6 mol 30 unq 0 iso 0 dist 8.204 8.90581 8.50024 7.88072 3.90342 5.6849 numMergedOcc 0
7 mol 48 unq 0 iso 0 dist 9.53081 6.42242 5.84184 5.43913 13.4515 10.8889 numMergedOcc 0
8 mol 48 unq 1 iso 0 dist 9.53081 6.42242 5.84184 8.26877 17.6258 13.697 numMergedOcc 0
9 mol 62 unq 0 iso 0 dist 9.11512 9.79863 5.05733 7.61377 3.90956 5.77803 numMergedOcc 0
10 mol 79 unq 0 iso 0 dist 8.64686 7.99438 14.0351 6.65972 4.13187 10.2709 numMergedOcc 0
11 mol 79 unq 1 iso 0 dist 8.64686 7.99438 14.0351 4.2253 9.13196 6.1647 numMergedOcc 0
12 mol 79 unq 2 iso 0 dist 8.64686 6.64915 13.4228 6.65972 4.13187 9.87964 numMergedOcc 0
13 mol 79 unq 3 iso 0 dist 8.64686 6.64915 13.4228 4.2253 9.13196 4.31939 numMergedOcc 0
14 mol 91 unq 0 iso 0 dist 8.91354 6.93893 5.06999 8.91998 10.8497 12.8723 numMergedOcc 0
15 mol 92 unq 0 iso 0 dist 7.70612 6.6186 5.04277 8.01266 4.51052 4.15826 numMergedOcc 0
16 mol 96 unq 0 iso 0 dist 8.9056 9.46568 14.7866 8.79886 11.9221 7.86339 numMergedOcc 0
17 mol 102 unq 0 iso 0 dist 8.03869 8.62829 3.99988 9.51771 10.5011 7.06835 numMergedOcc 0
18 mol 116 unq 0 iso 0 dist 6.53824 9.2638 10.5909 9.12145 4.82514 14.6696 numMergedOcc 0
19 mol 116 unq 1 iso 0 dist 6.53824 9.2638 10.5909 8.11048 5.7646 8.478 numMergedOcc 0
20 mol 116 unq 2 iso 0 dist 6.61973 9.2638 6.2875 9.12145 8.63935 14.6696 numMergedOcc 0
21 mol 116 unq 3 iso 0 dist 6.61973 9.2638 6.2875 8.11048 4.10222 8.478 numMergedOcc 0
22 mol 124 unq 0 iso 0 dist 7.18976 9.18949 11.7124 8.50362 5.3096 9.91987 numMergedOcc 0
23 mol 137 unq 0 iso 0 dist 9.1425 9.92905 9.84058 9.63793 5.20208 5.15237 numMergedOcc 0
24 mol 158 unq 0 iso 0 dist 9.38856 8.07946 9.75659 9.27714 3.91702 11.5349 numMergedOcc 0
25 mol 165 unq 0 iso 0 dist 6.85551 5.79029 6.57529 9.98689 6.21834 11.7621 numMergedOcc 0
26 mol 165 unq 1 iso 0 dist 6.85551 5.79029 6.57529 5.93144 11.5982 6.57937 numMergedOcc 0
27 mol 174 unq 0 iso 0 dist 7.27146 5.07761 4.80246 8.46317 5.30081 8.95182 numMergedOcc 0
28 mol 174 unq 1 iso 0 dist 6.25798 5.07761 9.44119 8.46317 5.41946 8.95182 numMergedOcc 0
29 mol 198 unq 0 iso 0 dist 8.51153 8.28295 5.3597 7.94413 7.14873 4.73496 numMergedOcc 0
30 mol 204 unq 0 iso 0 dist 9.52029 9.46973 4.29037 9.41594 9.47121 8.51539 numMergedOcc 0
31 mol 204 unq 1 iso 0 dist 9.52029 9.46973 4.29037 9.92651 11.8097 9.07662 numMergedOcc 0
32 mol 204 unq 2 iso 0 dist 6.20044 9.23676 4.92804 8.77524 6.42785 3.85186 numMergedOcc 0
33 mol 204 unq 3 iso 0 dist 8.41232 9.23676 5.04697 8.77524 7.66776 3.85186 numMergedOcc 0
34 mol 230 unq 0 iso 0 dist 9.24729 8.85051 9.16476 8.01593 3.86973 6.2222 numMergedOcc 0
35 mol 244 unq 0 iso 0 dist 7.43391 9.97458 16.3 9.3491 9.14405 11.7712 numMergedOcc 0
36 mol 244 unq 1 iso 0 dist 7.79787 9.97458 4.89551 9.3491 6.88123 11.7712 numMergedOcc 0
37 mol 252 unq 0 iso 0 dist 8.19645 7.60896 4.35762 9.09279 10.2121 10.3958 numMergedOcc 0
38 mol 254 unq 0 iso 0 dist 9.54511 7.00841 9.6988 5.83039 5.9731 4.4384 numMergedOcc 0
39 mol 254 unq 1 iso 0 dist 9.54511 7.00841 9.6988 6.74364 3.69576 6.09569 numMergedOcc 0
40 mol 256 unq 0 iso 0 dist 6.45473 9.65136 9.83915 6.33954 5.16057 5.59732 numMergedOcc 0
41 mol 272 unq 0 iso 0 dist 6.69245 8.86801 3.93924 9.30035 5.32967 6.85669 numMergedOcc 0
42 mol 272 unq 1 iso 0 dist 7.90763 7.15093 3.93924 9.51185 5.32967 6.85669 numMergedOcc 0
43 mol 273 unq 0 iso 0 dist 5.78262 9.57659 12.1916 8.13393 8.94124 6.18399 numMergedOcc 0
44 mol 273 unq 1 iso 0 dist 5.78262 7.8424 7.70478 8.13393 8.94124 3.91587 numMergedOcc 0
45 mol 273 unq 2 iso 0 dist 7.6489 9.57659 5.91118 8.13393 7.92723 6.18399 numMergedOcc 0
46 mol 273 unq 3 iso 0 dist 7.6489 7.8424 4.59769 8.13393 7.92723 3.91587 numMergedOcc 0
47 mol 279 unq 0 iso 0 dist 8.03486 9.29922 15.4124 9.98182 5.04826 18.0446 numMergedOcc 0
48 mol 284 unq 0 iso 0 dist 7.74965 4.87349 9.47092 8.2236 11.8933 9.94624 numMergedOcc 0
49 mol 285 unq 0 iso 0 dist 7.872 6.46935 9.75573 7.08681 11.2722 8.21781 numMergedOcc 0
50 mol 285 unq 1 iso 0 dist 7.872 6.46935 9.75573 4.95596 9.22192 9.60745 numMergedOcc 0
51 mol 285 unq 2 iso 0 dist 7.872 6.46935 9.75573 6.3508 8.37376 12.3762 numMergedOcc 0
52 mol 285 unq 3 iso 0 dist 7.872 6.46935 9.75573 8.3005 6.76283 8.69747 numMergedOcc 0
53 mol 285 unq 4 iso 0 dist 6.32984 6.46935 5.78887 7.08681 3.57803 8.21781 numMergedOcc 0
54 mol 285 unq 5 iso 0 dist 6.32984 6.46935 5.78887 4.95596 11.1099 9.60745 numMergedOcc 0
55 mol 285 unq 6 iso 0 dist 6.32984 6.46935 5.78887 6.3508 11.5761 12.3762 numMergedOcc 0
56 mol 285 unq 7 iso 0 dist 6.32984 6.46935 5.78887 8.3005 11.5053 8.69747 numMergedOcc 0
