0 mol 16 unq 0 iso 0 dist 8.62634 5.65481 9.04834 10.0664 8.17898 10.2656 numMergedOcc 0
1 mol 16 unq 0 iso 1 dist 8.62634 10.0664 8.17898 5.65481 9.04834 10.2656 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 8.71324 7.70414 9.10915 5.89729 7.02352 9.21892 numMergedOcc 0
3 mol 64 unq 0 iso 1 dist 8.71324 5.89729 7.02352 7.70414 9.10915 9.21892 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 7.70037 4.59504 8.24121 6.09189 8.52371 10.149 numMergedOcc 0
5 mol 69 unq 0 iso 1 dist 7.70037 6.09189 8.52371 4.59504 8.24121 10.149 numMergedOcc 0
6 mol 69 unq 1 iso 0 dist 7.70037 4.59504 8.24121 9.54683 6.8198 12.0119 numMergedOcc 0
7 mol 69 unq 1 iso 1 dist 7.70037 9.54683 6.8198 4.59504 8.24121 12.0119 numMergedOcc 0
8 mol 69 unq 1 iso 0 dist 7.70037 6.09189 8.52371 9.54683 6.8198 9.16015 numMergedOcc 0
9 mol 69 unq 1 iso 1 dist 7.70037 9.54683 6.8198 6.09189 8.52371 9.16015 numMergedOcc 0
10 mol 69 unq 2 iso 0 dist 7.96207 15.5565 8.24121 11.3689 8.52371 10.149 numMergedOcc 0
11 mol 69 unq 2 iso 1 dist 7.96207 11.3689 8.52371 15.5565 8.24121 10.149 numMergedOcc 0
12 mol 69 unq 3 iso 0 dist 7.96207 15.5565 8.24121 5.47165 6.8198 12.0119 numMergedOcc 0
13 mol 69 unq 3 iso 1 dist 7.96207 5.47165 6.8198 15.5565 8.24121 12.0119 numMergedOcc 0
14 mol 69 unq 3 iso 0 dist 7.96207 11.3689 8.52371 5.47165 6.8198 9.16015 numMergedOcc 0
15 mol 69 unq 3 iso 1 dist 7.96207 5.47165 6.8198 11.3689 8.52371 9.16015 numMergedOcc 0
16 mol 87 unq 0 iso 0 dist 8.21588 7.2527 9.1329 7.55603 9.33217 10.5639 numMergedOcc 0
17 mol 87 unq 0 iso 1 dist 8.21588 7.55603 9.33217 7.2527 9.1329 10.5639 numMergedOcc 0
18 mol 87 unq 1 iso 0 dist 8.21588 7.2527 9.1329 12.2598 9.03114 7.40574 numMergedOcc 0
19 mol 87 unq 1 iso 1 dist 8.21588 12.2598 9.03114 7.2527 9.1329 7.40574 numMergedOcc 0
20 mol 87 unq 1 iso 0 dist 8.21588 7.55603 9.33217 12.2598 9.03114 11.1798 numMergedOcc 0
21 mol 87 unq 1 iso 1 dist 8.21588 12.2598 9.03114 7.55603 9.33217 11.1798 numMergedOcc 0
22 mol 87 unq 2 iso 0 dist 6.62798 7.2527 5.26938 12.2598 8.91602 7.40574 numMergedOcc 0
23 mol 87 unq 2 iso 1 dist 6.62798 12.2598 8.91602 7.2527 5.26938 7.40574 numMergedOcc 0
24 mol 87 unq 3 iso 0 dist 8.15104 8.89893 9.1329 6.14857 9.33217 10.5639 numMergedOcc 0
25 mol 87 unq 3 iso 1 dist 8.15104 6.14857 9.33217 8.89893 9.1329 10.5639 numMergedOcc 0
26 mol 87 unq 4 iso 0 dist 8.15104 8.89893 9.1329 5.64484 9.03114 7.40574 numMergedOcc 0
27 mol 87 unq 4 iso 1 dist 8.15104 5.64484 9.03114 8.89893 9.1329 7.40574 numMergedOcc 0
28 mol 87 unq 4 iso 0 dist 8.15104 6.14857 9.33217 5.64484 9.03114 11.1798 numMergedOcc 0
29 mol 87 unq 4 iso 1 dist 8.15104 5.64484 9.03114 6.14857 9.33217 11.1798 numMergedOcc 0
30 mol 87 unq 5 iso 0 dist 9.94718 8.89893 5.26938 5.64484 8.91602 7.40574 numMergedOcc 0
31 mol 87 unq 5 iso 1 dist 9.94718 5.64484 8.91602 8.89893 5.26938 7.40574 numMergedOcc 0
32 mol 102 unq 0 iso 0 dist 6.7095 5.26061 7.48277 8.90571 9.0361 9.15076 numMergedOcc 0
33 mol 102 unq 0 iso 1 dist 6.7095 8.90571 9.0361 5.26061 7.48277 9.15076 numMergedOcc 0
34 mol 115 unq 0 iso 0 dist 5.91786 4.82909 6.20658 6.68557 7.83568 10.2788 numMergedOcc 0
35 mol 115 unq 0 iso 1 dist 5.91786 6.68557 7.83568 4.82909 6.20658 10.2788 numMergedOcc 0
36 mol 134 unq 0 iso 0 dist 9.24204 5.21119 5.67862 7.45628 7.97208 5.00817 numMergedOcc 0
37 mol 134 unq 0 iso 1 dist 9.24204 7.45628 7.97208 5.21119 5.67862 5.00817 numMergedOcc 0
38 mol 204 unq 0 iso 0 dist 7.55389 10.1816 7.7292 7.7596 6.27396 12.5143 numMergedOcc 0
39 mol 204 unq 0 iso 1 dist 7.55389 7.7596 6.27396 10.1816 7.7292 12.5143 numMergedOcc 0
40 mol 240 unq 0 iso 0 dist 7.84314 12.2549 6.83069 12.5785 9.30995 4.28414 numMergedOcc 0
41 mol 240 unq 0 iso 1 dist 7.84314 12.5785 9.30995 12.2549 6.83069 4.28414 numMergedOcc 0
42 mol 261 unq 0 iso 0 dist 8.36611 5.09075 7.15785 10.5849 9.43169 5.51688 numMergedOcc 0
43 mol 261 unq 0 iso 1 dist 8.36611 10.5849 9.43169 5.09075 7.15785 5.51688 numMergedOcc 0
