0 mol 4 unq 0 iso 0 dist 7.09907 9.0984 4.47629 8.92676 7.72343 12.186 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 9.18109 7.36836 15.1968 5.80438 6.40741 12.9209 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 9.18109 7.36836 15.1968 4.49056 9.31366 10.006 numMergedOcc 0
3 mol 37 unq 0 iso 0 dist 8.98177 9.03346 4.95968 12.7745 7.65758 10.95 numMergedOcc 0
4 mol 67 unq 0 iso 0 dist 6.23298 8.4702 11.6017 7.29309 9.30836 13.7596 numMergedOcc 0
5 mol 67 unq 1 iso 0 dist 6.23298 8.4702 11.6017 4.31746 6.58279 10.0501 numMergedOcc 0
6 mol 103 unq 0 iso 0 dist 6.71671 5.53454 5.59536 4.1431 9.5002 5.51053 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 9.79844 6.3323 5.26527 17.8562 9.10677 13.9958 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 6.85651 4.82356 3.75786 14.4497 8.70392 12.4466 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 7.03858 8.83476 3.75786 9.26708 8.70392 12.4466 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 6.00651 8.76449 6.99467 7.38323 5.08863 9.59327 numMergedOcc 0
11 mol 147 unq 1 iso 0 dist 6.00651 8.36182 4.53687 7.38323 5.08863 8.51399 numMergedOcc 0
12 mol 147 unq 2 iso 0 dist 8.52428 8.76449 10.4515 6.78733 9.21191 14.9303 numMergedOcc 0
13 mol 147 unq 3 iso 0 dist 8.52428 8.36182 9.02691 6.78733 9.21191 13.7615 numMergedOcc 0
14 mol 148 unq 0 iso 0 dist 5.55129 6.81449 8.33576 5.03347 7.32163 11.6262 numMergedOcc 0
15 mol 150 unq 0 iso 0 dist 5.53778 6.87593 8.23832 4.80033 7.42372 11.4868 numMergedOcc 0
16 mol 162 unq 0 iso 0 dist 9.51731 9.067 3.57652 7.15755 8.62413 5.67088 numMergedOcc 0
17 mol 183 unq 0 iso 0 dist 9.92635 7.16035 10.7786 8.96895 5.5781 12.6071 numMergedOcc 0
18 mol 183 unq 1 iso 0 dist 9.92635 6.2675 14.145 8.96895 5.5781 14.7791 numMergedOcc 0
19 mol 183 unq 2 iso 0 dist 7.85507 9.61725 10.7786 6.57004 5.5781 12.6071 numMergedOcc 0
20 mol 183 unq 3 iso 0 dist 7.85507 9.52042 14.145 6.57004 5.5781 14.7791 numMergedOcc 0
21 mol 192 unq 0 iso 0 dist 7.252 5.05414 9.52346 10.02 8.96522 14.829 numMergedOcc 0
22 mol 192 unq 1 iso 0 dist 7.252 5.05414 9.52346 7.02086 7.04366 11.2146 numMergedOcc 0
23 mol 192 unq 2 iso 0 dist 7.252 5.05414 9.52346 11.153 9.99783 10.9473 numMergedOcc 0
24 mol 192 unq 3 iso 0 dist 7.252 7.16964 6.78691 10.02 8.96522 14.5521 numMergedOcc 0
25 mol 192 unq 4 iso 0 dist 7.252 7.16964 6.78691 7.02086 7.04366 11.3832 numMergedOcc 0
26 mol 192 unq 5 iso 0 dist 7.252 7.16964 6.78691 11.153 9.99783 9.82753 numMergedOcc 0
27 mol 217 unq 0 iso 0 dist 5.89788 8.99517 5.14933 7.32888 9.37899 13.6552 numMergedOcc 0
28 mol 217 unq 1 iso 0 dist 5.89788 8.99517 5.14933 10.7793 6.14304 9.81531 numMergedOcc 0
29 mol 232 unq 0 iso 0 dist 7.99525 9.25334 3.68934 9.77057 9.92671 12.2421 numMergedOcc 0
30 mol 232 unq 1 iso 0 dist 9.20965 9.38205 3.68934 9.30551 9.92671 12.2421 numMergedOcc 0
31 mol 232 unq 2 iso 0 dist 9.20965 8.32831 13.1614 9.30551 9.92671 16.71 numMergedOcc 0
32 mol 232 unq 3 iso 0 dist 6.11539 8.54126 3.79439 9.74489 6.67239 9.89191 numMergedOcc 0
33 mol 232 unq 4 iso 0 dist 6.11539 8.54126 3.79439 6.70882 6.23146 9.83281 numMergedOcc 0
34 mol 232 unq 5 iso 0 dist 9.71082 9.33969 13.4178 16.2642 6.67239 19.247 numMergedOcc 0
35 mol 232 unq 6 iso 0 dist 9.71082 9.33969 13.4178 14.3107 6.23146 19.1135 numMergedOcc 0
36 mol 232 unq 7 iso 0 dist 9.71082 7.64079 3.79439 16.2642 6.67239 9.89191 numMergedOcc 0
37 mol 232 unq 8 iso 0 dist 9.71082 7.64079 3.79439 14.3107 6.23146 9.83281 numMergedOcc 0
38 mol 235 unq 0 iso 0 dist 8.88613 9.82099 13.1753 4.32578 6.86251 7.26232 numMergedOcc 0
39 mol 235 unq 1 iso 0 dist 8.88613 9.82099 13.1753 13.1619 6.20377 13.8663 numMergedOcc 0
40 mol 274 unq 0 iso 0 dist 8.14634 9.82713 9.90818 5.15747 9.02661 8.09181 numMergedOcc 0
41 mol 294 unq 0 iso 0 dist 5.27236 7.48987 4.99494 7.33654 6.1268 9.93413 numMergedOcc 0
42 mol 294 unq 1 iso 0 dist 5.27236 8.35637 9.15036 7.33654 6.1268 14.0663 numMergedOcc 0
