0 mol 10 unq 0 iso 0 dist 6.20404 4.62965 8.93461 11.1683 11.0871 9.78153 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 8.6783 4.69936 6.51139 6.74265 10.8697 6.75602 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.60396 11.3388 9.76585 14.3847 6.95983 8.84944 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 8.60396 11.3388 9.76585 10.2091 11.3999 7.21995 numMergedOcc 0
4 mol 43 unq 2 iso 0 dist 7.48969 14.9002 9.76585 12.7067 6.95983 8.84944 numMergedOcc 0
5 mol 43 unq 3 iso 0 dist 7.48969 14.9002 9.76585 17.917 11.3999 7.21995 numMergedOcc 0
6 mol 55 unq 0 iso 0 dist 8.57785 16.0564 8.95571 18.0281 11.806 9.24055 numMergedOcc 0
7 mol 55 unq 1 iso 0 dist 8.57785 16.0564 8.95571 20.4572 12.3757 9.66898 numMergedOcc 0
8 mol 55 unq 2 iso 0 dist 7.03751 4.42326 8.95571 12.0412 11.806 9.24055 numMergedOcc 0
9 mol 55 unq 3 iso 0 dist 7.03751 4.42326 8.95571 13.1181 12.3757 9.66898 numMergedOcc 0
10 mol 61 unq 0 iso 0 dist 8.65313 11.062 8.6338 17.3209 10.0633 8.8795 numMergedOcc 0
11 mol 61 unq 1 iso 0 dist 9.00513 6.52096 7.31677 13.1674 6.30737 8.8795 numMergedOcc 0
12 mol 61 unq 2 iso 0 dist 8.64665 9.50418 7.31677 13.9509 6.30737 8.8795 numMergedOcc 0
13 mol 69 unq 0 iso 0 dist 7.17678 8.98413 7.30652 15.1612 10.3741 7.03224 numMergedOcc 0
14 mol 79 unq 0 iso 0 dist 9.04935 4.82573 5.55798 7.78105 7.95422 8.61089 numMergedOcc 0
15 mol 79 unq 1 iso 0 dist 9.04935 4.82573 5.55798 13.2324 6.05149 8.64686 numMergedOcc 0
16 mol 99 unq 0 iso 0 dist 7.28774 6.04335 5.61946 12.4775 6.02095 8.68674 numMergedOcc 0
17 mol 103 unq 0 iso 0 dist 9.64736 3.9634 8.23356 8.10965 5.86578 6.56481 numMergedOcc 0
18 mol 115 unq 0 iso 0 dist 8.21127 5.73904 5.73946 10.879 4.75292 9.33293 numMergedOcc 0
19 mol 132 unq 0 iso 0 dist 7.64207 4.8602 8.72039 5.52837 7.53392 9.39389 numMergedOcc 0
20 mol 133 unq 0 iso 0 dist 9.86691 8.09812 6.9268 13.4646 8.75242 5.79195 numMergedOcc 0
21 mol 133 unq 1 iso 0 dist 9.86691 8.09812 6.9268 8.72732 14.0828 9.2759 numMergedOcc 0
22 mol 133 unq 2 iso 0 dist 9.86691 8.09812 6.9268 14.5023 15.4372 8.76088 numMergedOcc 0
23 mol 133 unq 3 iso 0 dist 5.59311 6.14253 9.56319 13.8059 14.3149 8.8353 numMergedOcc 0
24 mol 133 unq 4 iso 0 dist 5.7232 6.14253 9.73038 13.8059 17.9749 8.8353 numMergedOcc 0
25 mol 147 unq 0 iso 0 dist 6.28769 5.30543 5.47265 10.2396 7.75436 5.32865 numMergedOcc 0
26 mol 167 unq 0 iso 0 dist 9.38623 4.91302 6.28957 7.04009 5.44954 7.20545 numMergedOcc 0
27 mol 217 unq 0 iso 0 dist 9.51059 5.1774 7.80898 8.29482 4.10975 7.60302 numMergedOcc 0
28 mol 226 unq 0 iso 0 dist 6.17825 8.7629 9.03261 11.5161 9.96567 8.74399 numMergedOcc 0
29 mol 233 unq 0 iso 0 dist 9.49046 4.61365 8.01777 8.27169 12.4724 6.9103 numMergedOcc 0
30 mol 233 unq 1 iso 0 dist 7.24533 8.61205 8.01777 15.362 12.4724 6.9103 numMergedOcc 0
31 mol 236 unq 0 iso 0 dist 4.43243 7.15062 9.51001 9.80618 11.094 4.71683 numMergedOcc 0
32 mol 258 unq 0 iso 0 dist 8.6856 5.60485 8.17026 9.44669 6.30651 5.53369 numMergedOcc 0
33 mol 258 unq 1 iso 0 dist 8.6856 4.22701 8.43002 9.44669 6.30651 8.57274 numMergedOcc 0
34 mol 265 unq 0 iso 0 dist 8.09021 15.4423 9.94957 12.4357 4.47698 7.52632 numMergedOcc 0
35 mol 265 unq 1 iso 0 dist 6.98451 11.3503 9.94957 9.56106 4.47698 7.52632 numMergedOcc 0
36 mol 266 unq 0 iso 0 dist 8.00278 5.53565 7.3055 10.6206 6.1113 6.57444 numMergedOcc 0
37 mol 266 unq 1 iso 0 dist 8.00278 5.53565 7.3055 9.4961 14.487 9.39714 numMergedOcc 0
38 mol 266 unq 2 iso 0 dist 6.13722 4.19938 7.3055 7.07099 6.1113 6.57444 numMergedOcc 0
39 mol 266 unq 3 iso 0 dist 6.13722 4.19938 7.3055 8.3978 14.487 9.39714 numMergedOcc 0
40 mol 287 unq 0 iso 0 dist 7.90634 8.049 6.19545 8.50508 5.27724 5.15923 numMergedOcc 0
41 mol 287 unq 1 iso 0 dist 7.90634 5.05806 7.3388 9.04355 5.66584 6.96774 numMergedOcc 0
42 mol 287 unq 2 iso 0 dist 7.90634 11.1974 6.96248 9.04355 5.66584 7.14859 numMergedOcc 0
43 mol 288 unq 0 iso 0 dist 7.90634 8.049 6.19545 8.50508 5.27724 5.15923 numMergedOcc 0
44 mol 288 unq 1 iso 0 dist 7.90634 5.05806 7.3388 9.04355 5.66584 6.96774 numMergedOcc 0
45 mol 288 unq 2 iso 0 dist 7.90634 11.1974 6.96248 9.04355 5.66584 7.14859 numMergedOcc 0
46 mol 289 unq 0 iso 0 dist 7.90634 8.049 6.19545 8.50508 5.27724 5.15923 numMergedOcc 0
47 mol 289 unq 1 iso 0 dist 7.90634 5.05806 7.3388 9.04355 5.66584 6.96774 numMergedOcc 0
48 mol 289 unq 2 iso 0 dist 7.90634 11.1974 6.96248 9.04355 5.66584 7.14859 numMergedOcc 0
