0 mol 81 unq 0 iso 0 dist 9.61211 10.07 5.70283 14.1574 5.45312 7.15043 numMergedOcc 0
1 mol 81 unq 1 iso 0 dist 9.61211 13.9513 7.16741 14.1574 5.45312 5.86142 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 9.22903 10.6882 7.67463 19.1817 16.5258 9.43843 numMergedOcc 0
3 mol 135 unq 0 iso 0 dist 8.78439 12.116 7.74087 17.1961 9.60019 8.53533 numMergedOcc 0
4 mol 141 unq 0 iso 0 dist 7.53168 3.79724 4.70342 5.18805 10.7858 8.23543 numMergedOcc 0
5 mol 141 unq 1 iso 0 dist 5.18805 3.79724 8.23543 7.53168 10.7858 4.70342 numMergedOcc 0
6 mol 176 unq 0 iso 0 dist 8.56192 4.00045 5.60333 9.06564 3.17744 5.58647 numMergedOcc 0
7 mol 176 unq 1 iso 0 dist 8.56192 4.00045 5.60333 10.6536 5.47761 8.5733 numMergedOcc 0
8 mol 205 unq 0 iso 0 dist 9.88692 11.918 9.66947 13.6564 10.1158 5.69652 numMergedOcc 0
9 mol 252 unq 0 iso 0 dist 6.71152 12.8215 8.63893 21.1811 15.1028 9.84342 numMergedOcc 0
10 mol 254 unq 0 iso 0 dist 6.64866 4.04974 8.07881 5.39865 3.31939 5.44351 numMergedOcc 0
11 mol 254 unq 1 iso 0 dist 6.64866 4.04974 8.07881 5.0346 4.69077 6.34051 numMergedOcc 0
12 mol 254 unq 2 iso 0 dist 5.39865 4.04974 5.44351 6.64866 3.31939 8.07881 numMergedOcc 0
13 mol 254 unq 3 iso 0 dist 5.39865 4.04974 5.44351 5.0346 3.15539 6.34051 numMergedOcc 0
14 mol 254 unq 4 iso 0 dist 5.0346 4.04974 6.34051 6.64866 4.69077 8.07881 numMergedOcc 0
15 mol 254 unq 5 iso 0 dist 5.0346 4.04974 6.34051 5.39865 3.15539 5.44351 numMergedOcc 0
16 mol 254 unq 6 iso 0 dist 9.70628 15.4972 6.56151 15.2917 7.17324 7.09397 numMergedOcc 0
17 mol 254 unq 7 iso 0 dist 9.70628 15.4972 6.56151 7.98511 2.67738 8.3417 numMergedOcc 0
18 mol 254 unq 8 iso 0 dist 7.98511 15.4972 8.3417 15.2917 7.48499 7.09397 numMergedOcc 0
19 mol 254 unq 9 iso 0 dist 7.98511 15.4972 8.3417 9.70628 2.67738 6.56151 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 7.66814 10.7413 7.24165 9.72896 3.00605 8.53393 numMergedOcc 0
21 mol 283 unq 0 iso 0 dist 8.91437 12.1217 9.90494 18.3581 13.4236 9.74797 numMergedOcc 0
