0 mol 9 unq 0 iso 0 dist 8.01055 4.75533 7.48843 15.1393 9.00634 13.2185 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 8.01055 5.85081 4.07023 15.1393 9.00634 9.30603 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 9.29504 7.83083 15.0188 15.356 7.93277 19.1779 numMergedOcc 0
3 mol 10 unq 1 iso 0 dist 9.29504 7.83083 15.0188 6.23393 8.88888 13.4267 numMergedOcc 0
4 mol 10 unq 2 iso 0 dist 9.29504 6.90469 12.4341 15.356 7.93277 15.9038 numMergedOcc 0
5 mol 10 unq 3 iso 0 dist 9.29504 6.90469 12.4341 6.23393 8.88888 11.9194 numMergedOcc 0
6 mol 30 unq 0 iso 0 dist 8.204 7.88072 3.90342 4.5844 7.13565 8.67216 numMergedOcc 0
7 mol 43 unq 0 iso 0 dist 7.21995 8.81562 3.83842 6.53557 6.57633 10.2266 numMergedOcc 0
8 mol 48 unq 0 iso 0 dist 5.35252 7.99434 6.44604 5.76698 8.8645 7.78689 numMergedOcc 0
9 mol 48 unq 1 iso 0 dist 9.53081 5.43913 13.4515 12.665 7.34325 17.3341 numMergedOcc 0
10 mol 48 unq 2 iso 0 dist 9.53081 5.43913 13.4515 14.1985 6.42037 18.737 numMergedOcc 0
11 mol 48 unq 3 iso 0 dist 9.53081 8.26877 17.6258 12.665 7.34325 20.6489 numMergedOcc 0
12 mol 48 unq 4 iso 0 dist 9.53081 8.26877 17.6258 14.1985 6.42037 22.4406 numMergedOcc 0
13 mol 48 unq 5 iso 0 dist 5.06188 8.10222 6.4561 5.75684 8.3491 7.70645 numMergedOcc 0
14 mol 63 unq 0 iso 0 dist 6.49343 7.85738 12.6017 3.97936 9.06612 10.3553 numMergedOcc 0
15 mol 63 unq 1 iso 0 dist 6.49343 7.85738 12.6017 10.507 6.04797 17.5417 numMergedOcc 0
16 mol 63 unq 2 iso 0 dist 6.49343 7.85738 12.6017 15.191 8.88058 21.0983 numMergedOcc 0
17 mol 79 unq 0 iso 0 dist 8.64686 6.65972 4.13187 7.18389 7.82966 8.75375 numMergedOcc 0
18 mol 79 unq 1 iso 0 dist 8.64686 6.65972 4.13187 11.5374 8.26763 9.04293 numMergedOcc 0
19 mol 79 unq 2 iso 0 dist 8.64686 6.65972 4.13187 5.21981 6.30814 4.78333 numMergedOcc 0
20 mol 79 unq 3 iso 0 dist 8.64686 6.65972 4.13187 8.12985 7.318 9.18411 numMergedOcc 0
21 mol 79 unq 4 iso 0 dist 8.64686 4.2253 9.13196 7.18389 7.82966 9.14743 numMergedOcc 0
22 mol 79 unq 5 iso 0 dist 8.64686 4.2253 9.13196 11.5374 8.26763 10.8282 numMergedOcc 0
23 mol 79 unq 6 iso 0 dist 8.64686 4.2253 9.13196 5.21981 6.30814 4.74254 numMergedOcc 0
24 mol 79 unq 7 iso 0 dist 8.64686 4.2253 9.13196 8.12985 7.318 11.446 numMergedOcc 0
25 mol 83 unq 0 iso 0 dist 7.2118 7.69755 4.48523 9.38885 7.93119 11.0219 numMergedOcc 0
26 mol 83 unq 1 iso 0 dist 7.2118 7.69755 4.48523 4.93836 5.25361 5.35861 numMergedOcc 0
27 mol 91 unq 0 iso 0 dist 8.91354 8.91998 10.8497 5.09341 9.84288 7.71625 numMergedOcc 0
28 mol 96 unq 0 iso 0 dist 8.9056 8.79886 11.9221 6.29583 9.90938 13.1268 numMergedOcc 0
29 mol 127 unq 0 iso 0 dist 5.83719 9.64136 11.1718 7.4454 9.35701 16.2108 numMergedOcc 0
30 mol 157 unq 0 iso 0 dist 6.8976 8.36016 5.07066 5.332 8.9078 7.91458 numMergedOcc 0
31 mol 170 unq 0 iso 0 dist 8.10386 6.7638 6.72402 11.6479 9.66676 10.6388 numMergedOcc 0
32 mol 186 unq 0 iso 0 dist 6.72718 9.12589 9.57585 13.4486 8.09915 12.0605 numMergedOcc 0
33 mol 192 unq 0 iso 0 dist 7.36571 5.03588 3.9335 7.56199 7.75405 8.7652 numMergedOcc 0
34 mol 192 unq 1 iso 0 dist 9.17137 5.03588 10.6087 7.56199 7.49971 8.7652 numMergedOcc 0
35 mol 192 unq 2 iso 0 dist 9.17137 5.03588 10.6087 9.186 9.07427 13.4673 numMergedOcc 0
36 mol 195 unq 0 iso 0 dist 5.61326 9.16422 8.51428 7.83764 8.84149 16.0519 numMergedOcc 0
37 mol 205 unq 0 iso 0 dist 6.43519 8.83628 6.82382 6.31671 7.53734 7.68686 numMergedOcc 0
38 mol 210 unq 0 iso 0 dist 8.05949 7.95917 4.68656 10.8542 7.80421 11.1484 numMergedOcc 0
39 mol 210 unq 1 iso 0 dist 8.05949 7.95917 4.68656 14.6074 9.71107 14.2309 numMergedOcc 0
40 mol 210 unq 2 iso 0 dist 8.05949 7.95917 4.68656 13.6787 9.7449 13.7219 numMergedOcc 0
41 mol 224 unq 0 iso 0 dist 8.8113 6.06793 5.77577 6.97024 7.71863 7.99036 numMergedOcc 0
42 mol 244 unq 0 iso 0 dist 7.79787 9.3491 6.88123 8.65358 8.93589 14.4958 numMergedOcc 0
43 mol 249 unq 0 iso 0 dist 3.67935 6.62413 4.49386 6.46469 8.56493 11.0585 numMergedOcc 0
44 mol 266 unq 0 iso 0 dist 9.0836 6.48382 7.63149 7.90149 8.9221 8.20376 numMergedOcc 0
45 mol 266 unq 1 iso 0 dist 9.62494 6.48382 4.39553 7.90149 9.51145 8.20376 numMergedOcc 0
46 mol 277 unq 0 iso 0 dist 8.15119 4.1545 9.21484 6.65084 6.42951 5.13533 numMergedOcc 0
47 mol 277 unq 1 iso 0 dist 8.15119 4.25172 10.3506 6.65084 6.42951 8.0969 numMergedOcc 0
48 mol 279 unq 0 iso 0 dist 8.03486 9.98182 5.04826 4.91802 8.34313 11.6824 numMergedOcc 0
49 mol 287 unq 0 iso 0 dist 7.14859 9.31611 8.95194 13.8618 8.43856 15.192 numMergedOcc 0
50 mol 288 unq 0 iso 0 dist 7.14859 9.31611 8.95194 13.8618 8.43856 15.192 numMergedOcc 0
51 mol 289 unq 0 iso 0 dist 7.14859 9.31611 8.95194 13.8618 8.43856 15.192 numMergedOcc 0
