0 mol 53 unq 0 iso 0 dist 7.08383 9.26043 6.98616 7.72123 10.4874 15.7824 numMergedOcc 0
1 mol 53 unq 0 iso 1 dist 7.08383 7.72123 10.4874 9.26043 6.98616 15.7824 numMergedOcc 0
2 mol 88 unq 0 iso 0 dist 5.59846 7.98124 3.8048 8.54948 5.53481 8.55351 numMergedOcc 0
3 mol 88 unq 0 iso 1 dist 5.59846 8.54948 5.53481 7.98124 3.8048 8.55351 numMergedOcc 0
4 mol 91 unq 0 iso 0 dist 7.62621 8.01351 6.16048 8.98201 14.1282 16.0295 numMergedOcc 0
5 mol 91 unq 0 iso 1 dist 7.62621 8.98201 14.1282 8.01351 6.16048 16.0295 numMergedOcc 0
6 mol 91 unq 1 iso 0 dist 7.62621 8.01351 6.16048 6.4026 9.28675 11.4334 numMergedOcc 0
7 mol 91 unq 1 iso 1 dist 7.62621 6.4026 9.28675 8.01351 6.16048 11.4334 numMergedOcc 0
8 mol 91 unq 1 iso 0 dist 7.62621 8.98201 14.1282 6.4026 9.28675 5.61055 numMergedOcc 0
9 mol 91 unq 1 iso 1 dist 7.62621 6.4026 9.28675 8.98201 14.1282 5.61055 numMergedOcc 0
10 mol 104 unq 0 iso 0 dist 7.45407 9.0159 11.1508 5.46461 5.87427 12.6137 numMergedOcc 0
11 mol 104 unq 0 iso 1 dist 7.45407 5.46461 5.87427 9.0159 11.1508 12.6137 numMergedOcc 0
12 mol 123 unq 0 iso 0 dist 7.25497 7.99359 5.8424 9.14514 10.835 13.8924 numMergedOcc 0
13 mol 123 unq 0 iso 1 dist 7.25497 9.14514 10.835 7.99359 5.8424 13.8924 numMergedOcc 0
14 mol 124 unq 0 iso 0 dist 8.48985 8.40121 9.90566 9.09998 5.84105 6.96928 numMergedOcc 0
15 mol 124 unq 0 iso 1 dist 8.48985 9.09998 5.84105 8.40121 9.90566 6.96928 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 9.8678 9.4961 17.1354 8.08479 17.2672 8.19601 numMergedOcc 0
17 mol 266 unq 0 iso 1 dist 9.8678 8.08479 17.2672 9.4961 17.1354 8.19601 numMergedOcc 0
18 mol 266 unq 1 iso 0 dist 8.00278 9.4961 14.487 8.08479 15.9267 8.19601 numMergedOcc 0
19 mol 266 unq 1 iso 1 dist 8.00278 8.08479 15.9267 9.4961 14.487 8.19601 numMergedOcc 0
20 mol 266 unq 2 iso 0 dist 9.10275 7.07099 10.5702 8.83873 7.16658 11.6004 numMergedOcc 0
21 mol 266 unq 2 iso 1 dist 9.10275 8.83873 7.16658 7.07099 10.5702 11.6004 numMergedOcc 0
22 mol 266 unq 3 iso 0 dist 9.10275 7.07099 10.5702 8.3978 17.1354 13.1611 numMergedOcc 0
23 mol 266 unq 3 iso 1 dist 9.10275 8.3978 17.1354 7.07099 10.5702 13.1611 numMergedOcc 0
24 mol 266 unq 3 iso 0 dist 9.10275 8.83873 7.16658 8.3978 17.1354 14.3542 numMergedOcc 0
25 mol 266 unq 3 iso 1 dist 9.10275 8.3978 17.1354 8.83873 7.16658 14.3542 numMergedOcc 0
26 mol 266 unq 4 iso 0 dist 6.13722 7.07099 6.1113 8.83873 8.64084 11.6004 numMergedOcc 0
27 mol 266 unq 4 iso 1 dist 6.13722 8.83873 8.64084 7.07099 6.1113 11.6004 numMergedOcc 0
28 mol 266 unq 5 iso 0 dist 6.13722 7.07099 6.1113 8.3978 14.487 13.1611 numMergedOcc 0
29 mol 266 unq 5 iso 1 dist 6.13722 8.3978 14.487 7.07099 6.1113 13.1611 numMergedOcc 0
30 mol 266 unq 5 iso 0 dist 6.13722 8.83873 8.64084 8.3978 14.487 14.3542 numMergedOcc 0
31 mol 266 unq 5 iso 1 dist 6.13722 8.3978 14.487 8.83873 8.64084 14.3542 numMergedOcc 0
32 mol 279 unq 0 iso 0 dist 8.53542 7.69328 8.91353 8.93979 6.05412 13.13 numMergedOcc 0
33 mol 279 unq 0 iso 1 dist 8.53542 8.93979 6.05412 7.69328 8.91353 13.13 numMergedOcc 0
34 mol 287 unq 0 iso 0 dist 7.75212 9.04355 9.33717 8.50508 11.7739 10.6227 numMergedOcc 0
35 mol 287 unq 0 iso 1 dist 7.75212 8.50508 11.7739 9.04355 9.33717 10.6227 numMergedOcc 0
36 mol 287 unq 1 iso 0 dist 7.90634 9.04355 5.66584 8.50508 5.27724 10.6227 numMergedOcc 0
37 mol 287 unq 1 iso 1 dist 7.90634 8.50508 5.27724 9.04355 5.66584 10.6227 numMergedOcc 0
38 mol 288 unq 0 iso 0 dist 7.75212 9.04355 9.33717 8.50508 11.7739 10.6227 numMergedOcc 0
39 mol 288 unq 0 iso 1 dist 7.75212 8.50508 11.7739 9.04355 9.33717 10.6227 numMergedOcc 0
40 mol 288 unq 1 iso 0 dist 7.90634 9.04355 5.66584 8.50508 5.27724 10.6227 numMergedOcc 0
41 mol 288 unq 1 iso 1 dist 7.90634 8.50508 5.27724 9.04355 5.66584 10.6227 numMergedOcc 0
42 mol 289 unq 0 iso 0 dist 7.75212 9.04355 9.33717 8.50508 11.7739 10.6227 numMergedOcc 0
43 mol 289 unq 0 iso 1 dist 7.75212 8.50508 11.7739 9.04355 9.33717 10.6227 numMergedOcc 0
44 mol 289 unq 1 iso 0 dist 7.90634 9.04355 5.66584 8.50508 5.27724 10.6227 numMergedOcc 0
45 mol 289 unq 1 iso 1 dist 7.90634 8.50508 5.27724 9.04355 5.66584 10.6227 numMergedOcc 0
