0 mol 19 unq 0 iso 0 dist 9.50382 8.6541 8.76559 5.83115 9.65404 4.06798 numMergedOcc 0
1 mol 19 unq 0 iso 1 dist 8.76559 8.6541 9.50382 4.06798 9.65404 5.83115 numMergedOcc 0
2 mol 55 unq 0 iso 0 dist 9.30367 15.0918 6.67079 17.9272 9.77301 6.83662 numMergedOcc 0
3 mol 55 unq 0 iso 1 dist 6.67079 15.0918 9.30367 6.83662 9.77301 17.9272 numMergedOcc 0
4 mol 126 unq 0 iso 0 dist 7.25133 13.7598 9.33622 6.26197 9.93897 12.5693 numMergedOcc 0
5 mol 126 unq 0 iso 1 dist 9.33622 13.7598 7.25133 12.5693 9.93897 6.26197 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 9.07294 12.1681 7.50126 11.7194 8.60913 11.2716 numMergedOcc 0
7 mol 133 unq 0 iso 1 dist 7.50126 12.1681 9.07294 11.2716 8.60913 11.7194 numMergedOcc 0
8 mol 152 unq 0 iso 0 dist 5.59682 9.80549 7.71277 4.75398 9.8492 14.256 numMergedOcc 0
9 mol 152 unq 0 iso 1 dist 7.71277 9.80549 5.59682 14.256 9.8492 4.75398 numMergedOcc 0
10 mol 183 unq 0 iso 0 dist 6.21267 7.42362 7.41743 3.97176 8.74697 11.2781 numMergedOcc 0
11 mol 183 unq 0 iso 1 dist 7.41743 7.42362 6.21267 11.2781 8.74697 3.97176 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 9.68829 9.49253 7.75205 4.19782 9.79058 9.91623 numMergedOcc 0
13 mol 205 unq 0 iso 1 dist 7.75205 9.49253 9.68829 9.91623 9.79058 4.19782 numMergedOcc 0
14 mol 218 unq 0 iso 0 dist 4.61671 6.98423 8.44004 5.88377 8.73468 7.38609 numMergedOcc 0
15 mol 218 unq 0 iso 1 dist 8.44004 6.98423 4.61671 7.38609 8.73468 5.88377 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 8.94094 8.69256 9.35184 10.3091 9.99265 12.5049 numMergedOcc 0
17 mol 220 unq 0 iso 1 dist 9.35184 8.69256 8.94094 12.5049 9.99265 10.3091 numMergedOcc 0
18 mol 224 unq 0 iso 0 dist 7.47122 11.1434 6.6537 8.09748 8.23071 6.63295 numMergedOcc 0
19 mol 224 unq 0 iso 1 dist 6.6537 11.1434 7.47122 6.63295 8.23071 8.09748 numMergedOcc 0
20 mol 224 unq 1 iso 0 dist 5.97988 11.1019 9.08719 8.60417 9.79842 7.00684 numMergedOcc 0
21 mol 224 unq 1 iso 1 dist 9.08719 11.1019 5.97988 7.00684 9.79842 8.60417 numMergedOcc 0
22 mol 233 unq 0 iso 0 dist 7.21238 9.20332 9.80985 9.3528 8.88148 8.26315 numMergedOcc 0
23 mol 233 unq 0 iso 1 dist 9.80985 9.20332 7.21238 8.26315 8.88148 9.3528 numMergedOcc 0
24 mol 259 unq 0 iso 0 dist 8.73077 5.25969 6.76656 9.58306 6.13752 9.68247 numMergedOcc 0
25 mol 259 unq 0 iso 1 dist 6.76656 5.25969 8.73077 9.68247 6.13752 9.58306 numMergedOcc 0
26 mol 266 unq 0 iso 0 dist 6.58277 6.70676 8.42706 4.56912 9.12381 5.43295 numMergedOcc 0
27 mol 266 unq 0 iso 1 dist 8.42706 6.70676 6.58277 5.43295 9.12381 4.56912 numMergedOcc 0
28 mol 266 unq 1 iso 0 dist 6.58277 6.70676 8.42706 8.89693 8.79148 7.37367 numMergedOcc 0
29 mol 266 unq 1 iso 1 dist 8.42706 6.70676 6.58277 7.37367 8.79148 8.89693 numMergedOcc 0
30 mol 266 unq 2 iso 0 dist 6.58277 6.70676 8.42706 14.5953 8.14167 15.7187 numMergedOcc 0
31 mol 266 unq 2 iso 1 dist 8.42706 6.70676 6.58277 15.7187 8.14167 14.5953 numMergedOcc 0
32 mol 266 unq 3 iso 0 dist 6.58277 13.1611 8.12204 4.56912 9.12381 15.9506 numMergedOcc 0
33 mol 266 unq 3 iso 1 dist 8.12204 13.1611 6.58277 15.9506 9.12381 4.56912 numMergedOcc 0
34 mol 266 unq 4 iso 0 dist 6.58277 13.1611 8.12204 8.89693 8.79148 14.4053 numMergedOcc 0
35 mol 266 unq 4 iso 1 dist 8.12204 13.1611 6.58277 14.4053 8.79148 8.89693 numMergedOcc 0
36 mol 266 unq 5 iso 0 dist 6.58277 13.1611 8.12204 14.5953 8.14167 5.69904 numMergedOcc 0
37 mol 266 unq 5 iso 1 dist 8.12204 13.1611 6.58277 5.69904 8.14167 14.5953 numMergedOcc 0
38 mol 266 unq 3 iso 0 dist 8.42706 16.4476 8.12204 5.43295 9.12381 15.9506 numMergedOcc 0
39 mol 266 unq 3 iso 1 dist 8.12204 16.4476 8.42706 15.9506 9.12381 5.43295 numMergedOcc 0
40 mol 266 unq 4 iso 0 dist 8.42706 16.4476 8.12204 7.37367 8.79148 14.4053 numMergedOcc 0
41 mol 266 unq 4 iso 1 dist 8.12204 16.4476 8.42706 14.4053 8.79148 7.37367 numMergedOcc 0
42 mol 266 unq 5 iso 0 dist 8.42706 16.4476 8.12204 15.7187 8.14167 5.69904 numMergedOcc 0
43 mol 266 unq 5 iso 1 dist 8.12204 16.4476 8.42706 5.69904 8.14167 15.7187 numMergedOcc 0
44 mol 282 unq 0 iso 0 dist 8.61456 5.92133 8.41041 4.44911 9.8362 9.11051 numMergedOcc 0
45 mol 282 unq 0 iso 1 dist 8.41041 5.92133 8.61456 9.11051 9.8362 4.44911 numMergedOcc 0
46 mol 294 unq 0 iso 0 dist 5.76337 9.4329 8.60441 5.78097 8.49287 7.10587 numMergedOcc 0
47 mol 294 unq 0 iso 1 dist 8.60441 9.4329 5.76337 7.10587 8.49287 5.78097 numMergedOcc 0
