0 mol 20 unq 0 iso 0 dist 6.29581 15.1592 9.28637 14.473 9.20198 9.10773 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 6.29581 15.1592 9.28637 3.78339 7.51452 15.544 numMergedOcc 0
2 mol 20 unq 2 iso 0 dist 5.21143 13.5917 9.28637 12.502 9.20198 9.10773 numMergedOcc 0
3 mol 20 unq 3 iso 0 dist 5.21143 13.5917 9.28637 6.18887 7.51452 15.544 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 8.69142 8.20469 8.84763 7.89671 6.46104 5.21858 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 8.69142 8.20469 8.84763 11.9181 7.36856 6.29941 numMergedOcc 0
6 mol 26 unq 2 iso 0 dist 8.43523 15.1176 8.84763 14.4644 6.46104 5.21858 numMergedOcc 0
7 mol 26 unq 3 iso 0 dist 8.43523 15.1176 8.84763 10.4441 7.36856 6.29941 numMergedOcc 0
8 mol 96 unq 0 iso 0 dist 5.19438 5.37184 9.46918 7.66327 8.39111 12.4028 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 9.88541 13.7103 6.65318 15.8326 6.60933 7.12509 numMergedOcc 0
10 mol 113 unq 0 iso 0 dist 8.49444 12.3335 5.7085 12.9469 8.8822 11.4228 numMergedOcc 0
11 mol 130 unq 0 iso 0 dist 7.35647 4.80863 9.73325 6.73179 9.72053 11.209 numMergedOcc 0
12 mol 130 unq 1 iso 0 dist 7.35647 4.80863 9.73325 12.7556 7.7949 12.8735 numMergedOcc 0
13 mol 130 unq 2 iso 0 dist 4.88366 8.88035 9.73325 8.77629 9.72053 11.209 numMergedOcc 0
14 mol 130 unq 3 iso 0 dist 4.88366 8.88035 9.73325 6.51295 7.7949 12.8735 numMergedOcc 0
15 mol 146 unq 0 iso 0 dist 6.4477 6.19438 6.28491 5.1208 8.84535 5.15943 numMergedOcc 0
16 mol 146 unq 1 iso 0 dist 6.4477 6.19438 6.28491 8.91039 8.82188 5.67737 numMergedOcc 0
17 mol 146 unq 2 iso 0 dist 7.92203 7.30463 6.28491 9.57404 8.84535 5.15943 numMergedOcc 0
18 mol 146 unq 3 iso 0 dist 7.92203 7.30463 6.28491 5.03943 8.82188 5.67737 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 6.19189 11.6286 8.28099 6.13422 7.76163 14.6912 numMergedOcc 0
20 mol 186 unq 1 iso 0 dist 6.19189 11.6286 8.28099 9.40374 8.73217 6.15341 numMergedOcc 0
21 mol 186 unq 2 iso 0 dist 8.34668 8.50695 8.28099 10.2733 7.76163 14.6912 numMergedOcc 0
22 mol 186 unq 3 iso 0 dist 8.34668 8.50695 8.28099 12.4751 8.73217 6.15341 numMergedOcc 0
23 mol 234 unq 0 iso 0 dist 5.74541 6.00606 8.88567 5.28657 6.30154 5.19951 numMergedOcc 0
24 mol 265 unq 0 iso 0 dist 7.87337 11.1233 6.99454 10.3482 6.71375 5.26386 numMergedOcc 0
25 mol 271 unq 0 iso 0 dist 6.7192 11.6207 8.97962 10.6358 8.98576 10.8708 numMergedOcc 0
26 mol 271 unq 1 iso 0 dist 6.7192 11.6207 8.97962 5.64566 8.92636 12.9071 numMergedOcc 0
