0 mol 11 unq 0 iso 0 dist 5.7435 5.42831 6.97875 11.1513 9.53002 7.75648 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 8.99491 11.1165 9.10915 6.84612 8.68586 12.9814 numMergedOcc 0
2 mol 64 unq 1 iso 0 dist 8.99491 13.6507 8.66921 6.84612 8.68586 11.75 numMergedOcc 0
3 mol 64 unq 2 iso 0 dist 8.99491 7.89444 5.54343 6.84612 8.68586 5.68492 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 8.04256 5.00567 6.87176 9.07668 7.96497 11.9261 numMergedOcc 0
5 mol 68 unq 1 iso 0 dist 8.04256 5.33771 5.57389 9.07668 7.96497 7.01859 numMergedOcc 0
6 mol 68 unq 2 iso 0 dist 7.51075 12.5342 6.87176 3.89794 7.96497 11.9261 numMergedOcc 0
7 mol 68 unq 3 iso 0 dist 7.51075 9.21957 5.57389 3.89794 7.96497 7.01859 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 8.2377 7.98579 4.24428 12.6436 5.64598 5.14919 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 6.18305 7.53682 6.30194 4.31731 4.65521 5.14919 numMergedOcc 0
10 mol 76 unq 0 iso 0 dist 6.4551 4.00834 4.83274 13.2281 9.49449 13.8036 numMergedOcc 0
11 mol 76 unq 1 iso 0 dist 6.4551 9.6911 7.89214 13.2281 9.49449 6.63393 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 4.98864 9.35695 9.56867 5.46352 6.99777 7.97477 numMergedOcc 0
13 mol 115 unq 1 iso 0 dist 4.98864 9.35695 9.56867 10.1017 9.14376 6.58038 numMergedOcc 0
14 mol 115 unq 2 iso 0 dist 7.95871 11.703 9.56867 10.3995 6.99777 7.97477 numMergedOcc 0
15 mol 115 unq 3 iso 0 dist 7.95871 11.703 9.56867 9.81323 9.14376 6.58038 numMergedOcc 0
16 mol 127 unq 0 iso 0 dist 9.42513 4.42983 7.73139 10.2034 9.81878 11.54 numMergedOcc 0
17 mol 127 unq 1 iso 0 dist 9.42513 9.88569 6.66607 10.2034 9.81878 6.09683 numMergedOcc 0
18 mol 127 unq 2 iso 0 dist 9.42513 5.88232 8.62711 10.2034 9.81878 13.376 numMergedOcc 0
19 mol 130 unq 0 iso 0 dist 5.49877 7.43279 9.05626 6.53156 6.89257 5.53247 numMergedOcc 0
20 mol 130 unq 1 iso 0 dist 5.49877 7.43279 9.05626 4.72188 8.74308 8.63186 numMergedOcc 0
21 mol 134 unq 0 iso 0 dist 9.60411 10.6313 5.67862 6.27009 5.42582 6.30187 numMergedOcc 0
22 mol 155 unq 0 iso 0 dist 6.7973 6.12669 7.28355 5.10076 7.16254 10.0058 numMergedOcc 0
23 mol 155 unq 1 iso 0 dist 6.7973 6.12669 7.28355 9.64056 9.86313 10.5375 numMergedOcc 0
24 mol 155 unq 2 iso 0 dist 4.44292 7.64573 8.66709 4.40049 7.39644 7.00069 numMergedOcc 0
25 mol 155 unq 3 iso 0 dist 4.44292 7.64573 8.66709 6.61119 7.70572 14.2312 numMergedOcc 0
26 mol 214 unq 0 iso 0 dist 9.51764 18.2005 9.40003 6.09245 6.97182 13.377 numMergedOcc 0
27 mol 214 unq 1 iso 0 dist 9.51764 18.2005 9.40003 10.8345 6.1175 9.36638 numMergedOcc 0
28 mol 214 unq 2 iso 0 dist 9.51764 4.74203 8.68385 6.09245 6.97182 8.07861 numMergedOcc 0
29 mol 214 unq 3 iso 0 dist 9.51764 4.74203 8.68385 10.8345 6.1175 10.2576 numMergedOcc 0
30 mol 214 unq 4 iso 0 dist 5.36829 4.87713 9.40003 8.69149 6.97182 13.377 numMergedOcc 0
31 mol 214 unq 5 iso 0 dist 5.36829 4.87713 9.40003 6.00706 6.1175 9.36638 numMergedOcc 0
32 mol 214 unq 6 iso 0 dist 5.36829 13.4762 8.68385 8.69149 6.97182 8.07861 numMergedOcc 0
33 mol 214 unq 7 iso 0 dist 5.36829 13.4762 8.68385 6.00706 6.1175 10.2576 numMergedOcc 0
34 mol 218 unq 0 iso 0 dist 8.5119 5.55907 9.88212 9.20149 7.18041 13.5954 numMergedOcc 0
35 mol 218 unq 1 iso 0 dist 8.5119 5.55907 9.88212 11.711 7.17547 12.7227 numMergedOcc 0
36 mol 222 unq 0 iso 0 dist 9.55777 12.6689 8.69148 5.78005 6.82208 8.62626 numMergedOcc 0
37 mol 236 unq 0 iso 0 dist 8.90987 7.84468 9.97357 14.3961 7.17676 11.4732 numMergedOcc 0
38 mol 236 unq 1 iso 0 dist 8.90987 7.84468 9.97357 12.7435 6.68463 14.1057 numMergedOcc 0
39 mol 253 unq 0 iso 0 dist 5.89502 7.60327 8.53729 11.889 7.19465 15.6651 numMergedOcc 0
40 mol 253 unq 1 iso 0 dist 5.89502 9.90493 8.07341 11.889 7.19465 14.0411 numMergedOcc 0
41 mol 253 unq 2 iso 0 dist 7.15815 13.127 8.53729 8.75798 7.19465 15.6651 numMergedOcc 0
42 mol 253 unq 3 iso 0 dist 7.15815 14.7487 8.07341 8.75798 7.19465 14.0411 numMergedOcc 0
43 mol 256 unq 0 iso 0 dist 7.67598 6.78978 8.43264 9.40096 5.24676 8.04009 numMergedOcc 0
44 mol 265 unq 0 iso 0 dist 9.772 9.91968 7.54805 5.55314 6.34034 8.3872 numMergedOcc 0
45 mol 266 unq 0 iso 0 dist 8.59986 6.31111 7.72749 10.0609 9.02188 13.5492 numMergedOcc 0
46 mol 272 unq 0 iso 0 dist 9.96394 12.1122 4.78812 5.98845 6.73206 6.99865 numMergedOcc 0
