0 mol 64 unq 0 iso 0 dist 6.6003 6.44118 5.87491 9.14856 5.68303 10.0075 numMergedOcc 0
1 mol 64 unq 0 iso 1 dist 6.44118 6.6003 5.87491 9.14856 10.0075 5.68303 numMergedOcc 0
2 mol 64 unq 1 iso 0 dist 6.6003 6.44118 5.87491 4.97843 4.94316 4.65281 numMergedOcc 0
3 mol 64 unq 1 iso 1 dist 6.44118 6.6003 5.87491 4.97843 4.65281 4.94316 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 9.90199 9.74996 14.3033 6.21735 4.77089 13.0324 numMergedOcc 0
5 mol 69 unq 0 iso 1 dist 9.74996 9.90199 14.3033 6.21735 13.0324 4.77089 numMergedOcc 0
6 mol 69 unq 1 iso 0 dist 9.90199 9.74996 14.3033 7.78321 12.9801 11.1718 numMergedOcc 0
7 mol 69 unq 1 iso 1 dist 9.74996 9.90199 14.3033 7.78321 11.1718 12.9801 numMergedOcc 0
8 mol 69 unq 2 iso 0 dist 9.90199 8.21667 9.1127 6.21735 4.77089 6.75422 numMergedOcc 0
9 mol 69 unq 2 iso 1 dist 8.21667 9.90199 9.1127 6.21735 6.75422 4.77089 numMergedOcc 0
10 mol 69 unq 3 iso 0 dist 9.90199 8.21667 9.1127 7.78321 12.9801 5.16281 numMergedOcc 0
11 mol 69 unq 3 iso 1 dist 8.21667 9.90199 9.1127 7.78321 5.16281 12.9801 numMergedOcc 0
12 mol 69 unq 2 iso 0 dist 9.74996 8.21667 10.149 6.21735 13.0324 6.75422 numMergedOcc 0
13 mol 69 unq 2 iso 1 dist 8.21667 9.74996 10.149 6.21735 6.75422 13.0324 numMergedOcc 0
14 mol 69 unq 3 iso 0 dist 9.74996 8.21667 10.149 7.78321 11.1718 5.16281 numMergedOcc 0
15 mol 69 unq 3 iso 1 dist 8.21667 9.74996 10.149 7.78321 5.16281 11.1718 numMergedOcc 0
16 mol 73 unq 0 iso 0 dist 9.68526 7.26679 15.7123 9.67601 12.3103 15.1106 numMergedOcc 0
17 mol 73 unq 0 iso 1 dist 7.26679 9.68526 15.7123 9.67601 15.1106 12.3103 numMergedOcc 0
18 mol 73 unq 1 iso 0 dist 9.68526 9.30776 13.7412 9.67601 12.3103 6.04779 numMergedOcc 0
19 mol 73 unq 1 iso 1 dist 9.30776 9.68526 13.7412 9.67601 6.04779 12.3103 numMergedOcc 0
20 mol 73 unq 1 iso 0 dist 7.26679 9.30776 12.016 9.67601 15.1106 6.04779 numMergedOcc 0
21 mol 73 unq 1 iso 1 dist 9.30776 7.26679 12.016 9.67601 6.04779 15.1106 numMergedOcc 0
22 mol 102 unq 0 iso 0 dist 9.43411 9.80678 9.15076 9.50209 4.32286 5.498 numMergedOcc 0
23 mol 102 unq 0 iso 1 dist 9.80678 9.43411 9.15076 9.50209 5.498 4.32286 numMergedOcc 0
24 mol 147 unq 0 iso 0 dist 9.84695 9.18866 15.2746 6.37424 9.29726 6.02355 numMergedOcc 0
25 mol 147 unq 0 iso 1 dist 9.18866 9.84695 15.2746 6.37424 6.02355 9.29726 numMergedOcc 0
26 mol 147 unq 1 iso 0 dist 9.84695 9.18866 15.2746 6.96704 4.93735 11.7284 numMergedOcc 0
27 mol 147 unq 1 iso 1 dist 9.18866 9.84695 15.2746 6.96704 11.7284 4.93735 numMergedOcc 0
28 mol 206 unq 0 iso 0 dist 9.72979 6.97859 7.08143 8.42763 4.8585 5.94313 numMergedOcc 0
29 mol 206 unq 0 iso 1 dist 6.97859 9.72979 7.08143 8.42763 5.94313 4.8585 numMergedOcc 0
30 mol 224 unq 0 iso 0 dist 9.34636 9.79616 4.70378 8.60781 7.98696 7.12232 numMergedOcc 0
31 mol 224 unq 0 iso 1 dist 9.79616 9.34636 4.70378 8.60781 7.12232 7.98696 numMergedOcc 0
32 mol 224 unq 1 iso 0 dist 9.33771 7.39839 5.0744 6.4508 5.29877 6.12232 numMergedOcc 0
33 mol 224 unq 1 iso 1 dist 7.39839 9.33771 5.0744 6.4508 6.12232 5.29877 numMergedOcc 0
34 mol 264 unq 0 iso 0 dist 9.01085 6.28512 5.57311 9.71218 7.20634 5.3148 numMergedOcc 0
35 mol 264 unq 0 iso 1 dist 6.28512 9.01085 5.57311 9.71218 5.3148 7.20634 numMergedOcc 0
36 mol 273 unq 0 iso 0 dist 8.90885 9.96963 5.96724 6.8391 4.89568 5.14347 numMergedOcc 0
37 mol 273 unq 0 iso 1 dist 9.96963 8.90885 5.96724 6.8391 5.14347 4.89568 numMergedOcc 0
38 mol 273 unq 1 iso 0 dist 8.90885 9.96963 5.96724 6.06557 11.5447 11.9894 numMergedOcc 0
39 mol 273 unq 1 iso 1 dist 9.96963 8.90885 5.96724 6.06557 11.9894 11.5447 numMergedOcc 0
40 mol 277 unq 0 iso 0 dist 8.57532 9.02914 9.50605 6.73204 5.01729 10.7534 numMergedOcc 0
41 mol 277 unq 0 iso 1 dist 9.02914 8.57532 9.50605 6.73204 10.7534 5.01729 numMergedOcc 0
42 mol 277 unq 1 iso 0 dist 8.57532 6.90434 12.7728 6.73204 5.01729 12.6113 numMergedOcc 0
43 mol 277 unq 1 iso 1 dist 6.90434 8.57532 12.7728 6.73204 12.6113 5.01729 numMergedOcc 0
44 mol 277 unq 1 iso 0 dist 9.02914 6.90434 7.08227 6.73204 10.7534 12.6113 numMergedOcc 0
45 mol 277 unq 1 iso 1 dist 6.90434 9.02914 7.08227 6.73204 12.6113 10.7534 numMergedOcc 0
