0 mol 15 unq 0 iso 0 dist 4.27439 9.63035 12.1014 7.57076 5.82801 10.4921 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 7.9118 5.84559 5.67737 8.35273 9.78953 11.7258 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 8.5884 6.48849 8.59325 9.04157 4.96019 11.5469 numMergedOcc 0
3 mol 28 unq 0 iso 0 dist 8.24316 8.85208 15.9562 6.76158 11.1346 12.3025 numMergedOcc 0
4 mol 28 unq 1 iso 0 dist 8.24316 8.85208 15.9562 7.423 10.8275 14.5006 numMergedOcc 0
5 mol 28 unq 2 iso 0 dist 8.24316 8.85208 15.9562 5.89257 7.90018 14.231 numMergedOcc 0
6 mol 28 unq 3 iso 0 dist 8.24316 9.04974 6.92962 6.76158 11.1346 13.7096 numMergedOcc 0
7 mol 28 unq 4 iso 0 dist 8.24316 9.04974 6.92962 7.423 10.8275 14.8826 numMergedOcc 0
8 mol 28 unq 5 iso 0 dist 8.24316 9.04974 6.92962 5.89257 7.90018 12.4379 numMergedOcc 0
9 mol 34 unq 0 iso 0 dist 9.29561 8.35897 8.27702 7.32472 7.65753 10.6836 numMergedOcc 0
10 mol 61 unq 0 iso 0 dist 4.4866 7.27623 4.56037 9.02073 6.95966 11.138 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 8.09587 9.76184 6.6711 9.06957 12.7617 14.2666 numMergedOcc 0
12 mol 88 unq 0 iso 0 dist 9.75856 9.05693 16.2126 9.57352 14.3183 3.87639 numMergedOcc 0
13 mol 88 unq 1 iso 0 dist 9.75856 7.45361 6.09578 9.57352 14.3183 9.76867 numMergedOcc 0
14 mol 103 unq 0 iso 0 dist 8.84955 7.4713 7.46374 7.91691 6.01221 3.95522 numMergedOcc 0
15 mol 103 unq 1 iso 0 dist 8.84955 8.91952 8.62264 7.91691 6.01221 12.8265 numMergedOcc 0
16 mol 143 unq 0 iso 0 dist 9.6112 6.35449 6.57809 6.91039 7.33175 3.66518 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 7.17789 8.39237 3.82682 8.94445 14.3694 13.4386 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 8.17723 9.89918 4.6408 7.39043 5.05766 7.72132 numMergedOcc 0
19 mol 236 unq 0 iso 0 dist 6.25412 9.26228 13.774 8.32786 5.50882 17.4068 numMergedOcc 0
20 mol 236 unq 1 iso 0 dist 6.25412 9.26228 13.774 5.09952 7.27142 6.73957 numMergedOcc 0
21 mol 257 unq 0 iso 0 dist 9.91996 8.68995 6.78634 8.71617 17.1974 13.4601 numMergedOcc 0
22 mol 260 unq 0 iso 0 dist 5.16772 5.72892 6.36561 7.13397 11.9315 11.064 numMergedOcc 0
23 mol 260 unq 1 iso 0 dist 5.16772 5.72892 6.36561 5.33278 8.79837 4.03195 numMergedOcc 0
24 mol 266 unq 0 iso 0 dist 8.78501 4.98594 11.8672 7.51951 15.5294 3.90822 numMergedOcc 0
25 mol 266 unq 1 iso 0 dist 5.59641 4.98594 9.91179 7.51951 12.1427 3.90822 numMergedOcc 0
