0 mol 51 unq 0 iso 0 dist 5.67627 11.4974 9.0709 5.69989 7.52921 11.0025 numMergedOcc 0
1 mol 52 unq 0 iso 0 dist 8.52979 11.4352 9.80098 5.55004 5.75761 6.55615 numMergedOcc 0
2 mol 52 unq 1 iso 0 dist 8.52979 14.6092 7.34143 5.55004 5.75761 9.64358 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 7.89001 12.2366 9.5589 5.97238 7.56581 8.17454 numMergedOcc 0
4 mol 100 unq 0 iso 0 dist 7.02792 11.4302 9.35224 6.2943 7.5951 6.35939 numMergedOcc 0
5 mol 100 unq 1 iso 0 dist 7.02792 6.20162 6.56369 6.2943 7.5951 4.46114 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 9.34456 4.83846 5.86073 6.48958 8.57673 5.05071 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 7.85025 4.26332 6.29155 8.06692 4.51266 5.47259 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 7.85025 11.5948 6.80239 8.06692 4.51266 4.70102 numMergedOcc 0
9 mol 133 unq 2 iso 0 dist 7.85025 13.8058 8.00618 8.06692 4.51266 6.56917 numMergedOcc 0
10 mol 170 unq 0 iso 0 dist 7.47249 6.8201 9.76807 6.57391 9.48574 10.9822 numMergedOcc 0
11 mol 197 unq 0 iso 0 dist 9.00273 12.3192 8.56633 15.4382 8.02386 8.98864 numMergedOcc 0
12 mol 197 unq 1 iso 0 dist 9.00273 12.3192 8.56633 6.09577 6.6259 6.24432 numMergedOcc 0
13 mol 197 unq 2 iso 0 dist 7.19387 11.7609 8.56633 14.7744 8.02386 8.98864 numMergedOcc 0
14 mol 197 unq 3 iso 0 dist 7.19387 11.7609 8.56633 8.6195 6.6259 6.24432 numMergedOcc 0
15 mol 234 unq 0 iso 0 dist 8.58958 16.0172 8.34494 10.7923 7.72403 10.3378 numMergedOcc 0
16 mol 234 unq 1 iso 0 dist 8.58958 14.7629 6.56247 10.7923 7.72403 8.83842 numMergedOcc 0
17 mol 234 unq 2 iso 0 dist 8.58958 13.5847 9.36357 10.7923 7.72403 5.43327 numMergedOcc 0
18 mol 234 unq 3 iso 0 dist 9.70004 10.9359 8.34494 13.3917 7.72403 10.3378 numMergedOcc 0
19 mol 234 unq 4 iso 0 dist 9.70004 14.3229 6.56247 13.3917 7.72403 8.83842 numMergedOcc 0
20 mol 234 unq 5 iso 0 dist 9.70004 17.5883 9.36357 13.3917 7.72403 5.43327 numMergedOcc 0
21 mol 234 unq 6 iso 0 dist 7.17987 14.7629 9.45496 10.7923 6.35438 8.83842 numMergedOcc 0
22 mol 234 unq 7 iso 0 dist 7.17987 13.5847 6.7625 10.7923 6.35438 5.43327 numMergedOcc 0
23 mol 239 unq 0 iso 0 dist 9.73858 7.43079 6.16342 9.77197 6.8597 9.26426 numMergedOcc 0
