0 mol 19 unq 0 iso 0 dist 6.10339 8.40416 8.6996 4.44441 8.96634 12.7679 numMergedOcc 0
1 mol 20 unq 0 iso 0 dist 7.16149 7.51452 3.61632 15.8767 9.0017 10.0528 numMergedOcc 0
2 mol 20 unq 1 iso 0 dist 7.16149 6.03547 4.32143 15.8767 9.0017 11.1324 numMergedOcc 0
3 mol 20 unq 2 iso 0 dist 9.4228 6.09764 7.3057 16.7341 9.74724 16.7621 numMergedOcc 0
4 mol 20 unq 3 iso 0 dist 9.4228 6.09764 7.3057 14.3516 9.13347 15.4119 numMergedOcc 0
5 mol 20 unq 4 iso 0 dist 9.4228 9.20198 13.0142 16.7341 9.74724 22.1087 numMergedOcc 0
6 mol 20 unq 5 iso 0 dist 9.4228 9.20198 13.0142 14.3516 9.13347 20.5718 numMergedOcc 0
7 mol 24 unq 0 iso 0 dist 8.80127 8.4051 3.4435 6.7846 7.18124 7.85986 numMergedOcc 0
8 mol 24 unq 1 iso 0 dist 8.80127 8.4051 3.4435 8.03955 6.47026 4.30252 numMergedOcc 0
9 mol 24 unq 2 iso 0 dist 8.80127 8.23446 12.6622 6.7846 7.18124 7.8619 numMergedOcc 0
10 mol 24 unq 3 iso 0 dist 8.80127 8.23446 12.6622 8.03955 6.47026 13.3176 numMergedOcc 0
11 mol 24 unq 4 iso 0 dist 8.80127 8.75662 7.63657 6.7846 7.18124 11.0098 numMergedOcc 0
12 mol 24 unq 5 iso 0 dist 8.80127 8.75662 7.63657 8.03955 6.47026 12.496 numMergedOcc 0
13 mol 24 unq 6 iso 0 dist 6.48457 8.60554 3.4435 13.2846 7.18124 7.85986 numMergedOcc 0
14 mol 24 unq 7 iso 0 dist 6.48457 8.60554 3.4435 12.3897 6.47026 4.30252 numMergedOcc 0
15 mol 24 unq 8 iso 0 dist 6.48457 8.44664 12.7748 13.2846 7.18124 19.3469 numMergedOcc 0
16 mol 24 unq 9 iso 0 dist 6.48457 8.44664 12.7748 12.3897 6.47026 18.4045 numMergedOcc 0
17 mol 24 unq 10 iso 0 dist 6.48457 9.44691 7.63657 13.2846 7.18124 11.0098 numMergedOcc 0
18 mol 24 unq 11 iso 0 dist 6.48457 9.44691 7.63657 12.3897 6.47026 12.496 numMergedOcc 0
19 mol 72 unq 0 iso 0 dist 4.69674 9.27838 11.7291 4.7874 6.48394 12.1747 numMergedOcc 0
20 mol 85 unq 0 iso 0 dist 8.77199 9.82915 4.58085 13.3089 9.43843 6.46549 numMergedOcc 0
21 mol 85 unq 1 iso 0 dist 8.77199 9.82915 4.58085 10.3737 7.67463 10.3185 numMergedOcc 0
22 mol 85 unq 2 iso 0 dist 8.81824 7.54568 13.2941 16.2205 9.43843 18.3588 numMergedOcc 0
23 mol 85 unq 3 iso 0 dist 8.81824 7.54568 13.2941 8.37717 7.67463 15.3758 numMergedOcc 0
24 mol 158 unq 0 iso 0 dist 6.64326 8.647 6.03833 6.05019 9.56702 7.20362 numMergedOcc 0
25 mol 176 unq 0 iso 0 dist 6.32146 7.33273 13.3098 5.02061 5.60333 11.3115 numMergedOcc 0
26 mol 176 unq 1 iso 0 dist 6.32146 7.33273 13.3098 6.40668 5.58647 13.2742 numMergedOcc 0
27 mol 176 unq 2 iso 0 dist 6.32146 7.33273 13.3098 10.3398 8.5733 16.5611 numMergedOcc 0
28 mol 182 unq 0 iso 0 dist 9.07173 6.73956 9.39191 6.1548 8.58391 11.9309 numMergedOcc 0
29 mol 182 unq 1 iso 0 dist 9.07173 7.09394 3.6277 6.1548 8.58391 9.02127 numMergedOcc 0
30 mol 196 unq 0 iso 0 dist 6.11835 6.86319 3.68546 12.4987 8.94198 6.14222 numMergedOcc 0
31 mol 196 unq 1 iso 0 dist 9.93668 6.86319 6.56216 12.4987 9.49159 6.14222 numMergedOcc 0
32 mol 205 unq 0 iso 0 dist 7.23959 6.03688 9.6084 6.49049 8.42716 5.59832 numMergedOcc 0
33 mol 206 unq 0 iso 0 dist 7.03546 8.07687 6.97126 9.1131 7.51798 13.8013 numMergedOcc 0
34 mol 206 unq 1 iso 0 dist 9.73419 6.16414 7.87274 4.46135 9.24832 7.9416 numMergedOcc 0
35 mol 206 unq 2 iso 0 dist 9.73419 7.33701 12.04 4.46135 9.24832 11.4622 numMergedOcc 0
36 mol 206 unq 3 iso 0 dist 9.73419 8.0871 15.182 4.46135 9.24832 12.5259 numMergedOcc 0
37 mol 206 unq 4 iso 0 dist 6.11803 7.75885 7.87274 3.56132 9.24832 7.9416 numMergedOcc 0
38 mol 231 unq 0 iso 0 dist 7.31553 6.98875 6.90849 6.63423 5.45266 10.3577 numMergedOcc 0
39 mol 258 unq 0 iso 0 dist 5.8473 7.6595 5.58975 5.82277 8.27566 11.6045 numMergedOcc 0
40 mol 278 unq 0 iso 0 dist 5.77089 6.62841 7.27472 5.33325 9.68335 7.1656 numMergedOcc 0
41 mol 287 unq 0 iso 0 dist 9.29241 6.89451 5.41757 4.21609 8.70479 7.99204 numMergedOcc 0
42 mol 288 unq 0 iso 0 dist 9.29241 6.89451 5.41757 4.21609 8.70479 7.99204 numMergedOcc 0
43 mol 289 unq 0 iso 0 dist 9.29241 6.89451 5.41757 4.21609 8.70479 7.99204 numMergedOcc 0
