0 mol 27 unq 0 iso 0 dist 9.48375 9.62305 15.4799 9.40953 17.1356 13.8902 numMergedOcc 0
1 mol 27 unq 1 iso 0 dist 9.48375 9.62305 15.4799 9.57896 16.6725 8.7053 numMergedOcc 0
2 mol 27 unq 2 iso 0 dist 6.85127 9.62305 14.1714 9.40953 12.1419 13.8902 numMergedOcc 0
3 mol 27 unq 3 iso 0 dist 6.85127 9.62305 14.1714 9.57896 12.5927 8.7053 numMergedOcc 0
4 mol 27 unq 4 iso 0 dist 8.58169 9.62305 12.3417 9.40953 5.68274 13.8902 numMergedOcc 0
5 mol 27 unq 5 iso 0 dist 8.58169 9.62305 12.3417 9.57896 5.5733 8.7053 numMergedOcc 0
6 mol 43 unq 0 iso 0 dist 8.83248 9.467 5.13123 9.4658 7.20713 5.4932 numMergedOcc 0
7 mol 53 unq 0 iso 0 dist 7.57227 7.61429 4.94089 7.27048 5.38541 6.57749 numMergedOcc 0
8 mol 103 unq 0 iso 0 dist 5.72494 8.68825 11.8761 9.43076 4.78648 13.5811 numMergedOcc 0
9 mol 103 unq 1 iso 0 dist 8.70106 8.68825 13.2825 9.43076 10.6434 13.5811 numMergedOcc 0
10 mol 124 unq 0 iso 0 dist 6.31232 7.87439 10.5562 9.18988 10.4469 4.65349 numMergedOcc 0
11 mol 124 unq 1 iso 0 dist 6.79597 4.89099 5.16528 8.89976 5.18107 4.65349 numMergedOcc 0
12 mol 124 unq 2 iso 0 dist 7.17224 7.87439 5.16528 9.18988 5.18107 4.65349 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 4.46578 8.1716 6.95294 8.64976 4.97581 5.74928 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 4.46578 8.1716 6.95294 9.52159 7.96289 3.98677 numMergedOcc 0
15 mol 148 unq 0 iso 0 dist 8.60157 9.69869 8.92915 9.8506 16.0449 11.6297 numMergedOcc 0
16 mol 148 unq 1 iso 0 dist 8.60157 4.7785 6.43817 9.8506 16.0449 9.62909 numMergedOcc 0
17 mol 148 unq 2 iso 0 dist 6.72591 9.69869 5.27089 9.8506 8.01366 11.6297 numMergedOcc 0
18 mol 148 unq 3 iso 0 dist 6.72591 4.7785 6.16168 9.8506 8.01366 9.62909 numMergedOcc 0
19 mol 150 unq 0 iso 0 dist 8.59359 9.67177 8.91101 9.91991 16.1293 11.7198 numMergedOcc 0
20 mol 150 unq 1 iso 0 dist 8.59359 4.79493 6.48058 9.91991 16.1293 9.66857 numMergedOcc 0
21 mol 150 unq 2 iso 0 dist 6.80192 9.67177 5.24014 9.91991 8.04136 11.7198 numMergedOcc 0
22 mol 150 unq 3 iso 0 dist 6.80192 4.79493 6.14967 9.91991 8.04136 9.66857 numMergedOcc 0
23 mol 157 unq 0 iso 0 dist 6.66184 9.63472 12.5837 4.20542 5.332 9.61577 numMergedOcc 0
24 mol 157 unq 1 iso 0 dist 6.66184 9.63472 12.5837 8.40948 7.95661 7.32006 numMergedOcc 0
25 mol 168 unq 0 iso 0 dist 9.58783 8.75994 11.6512 4.68544 13.7197 9.05528 numMergedOcc 0
26 mol 168 unq 1 iso 0 dist 9.58783 6.80155 14.1838 4.68544 13.7197 6.84998 numMergedOcc 0
27 mol 184 unq 0 iso 0 dist 9.0757 5.87728 12.848 9.53656 13.9278 6.14273 numMergedOcc 0
28 mol 184 unq 1 iso 0 dist 9.0757 5.87728 12.848 7.06562 11.2707 6.8288 numMergedOcc 0
29 mol 184 unq 2 iso 0 dist 9.0757 6.71538 6.36605 9.53656 13.9278 11.7559 numMergedOcc 0
30 mol 184 unq 3 iso 0 dist 9.0757 6.71538 6.36605 7.06562 11.2707 5.14314 numMergedOcc 0
31 mol 184 unq 4 iso 0 dist 9.0757 8.58856 8.2618 9.53656 13.9278 6.51384 numMergedOcc 0
32 mol 184 unq 5 iso 0 dist 9.0757 8.58856 8.2618 7.06562 11.2707 10.6226 numMergedOcc 0
33 mol 184 unq 6 iso 0 dist 7.51045 6.76009 8.2618 8.32647 14.7937 9.48007 numMergedOcc 0
34 mol 278 unq 0 iso 0 dist 9.48559 7.08899 7.96744 5.74676 7.65985 4.52322 numMergedOcc 0
