0 mol 10 unq 0 iso 0 dist 6.7221 8.40467 3.96253 7.30932 5.66127 8.31255 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 6.07388 8.95648 5.67014 4.66195 3.54066 4.76781 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 5.46305 5.55479 3.40337 9.36493 13.3443 11.2499 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 5.46305 5.55479 3.40337 9.0665 9.4154 7.20258 numMergedOcc 0
4 mol 34 unq 2 iso 0 dist 5.46305 5.55479 3.40337 7.07773 4.24673 6.48477 numMergedOcc 0
5 mol 36 unq 0 iso 0 dist 8.46304 9.55519 3.35055 7.90158 7.34881 7.69482 numMergedOcc 0
6 mol 44 unq 0 iso 0 dist 8.27987 9.1276 8.88563 5.89913 6.07306 5.33571 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 6.09964 6.63733 6.13696 4.5892 3.40476 3.07021 numMergedOcc 0
8 mol 116 unq 0 iso 0 dist 8.58853 7.31364 7.72516 6.82267 9.45081 3.43966 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 9.3959 7.86997 8.68485 9.08818 5.18849 6.43304 numMergedOcc 0
10 mol 186 unq 1 iso 0 dist 9.3959 7.86997 8.68485 7.93563 14.5433 7.36003 numMergedOcc 0
11 mol 186 unq 2 iso 0 dist 9.3959 7.86997 8.68485 5.70056 10.0163 3.2635 numMergedOcc 0
12 mol 186 unq 3 iso 0 dist 9.3959 6.80944 5.33111 9.08818 5.18849 4.46688 numMergedOcc 0
13 mol 186 unq 4 iso 0 dist 9.3959 6.80944 5.33111 7.93563 14.5433 9.6068 numMergedOcc 0
14 mol 186 unq 5 iso 0 dist 9.3959 6.80944 5.33111 5.70056 10.0163 4.9849 numMergedOcc 0
15 mol 231 unq 0 iso 0 dist 9.44142 9.37406 10.8506 6.8533 10.1118 5.63585 numMergedOcc 0
16 mol 231 unq 1 iso 0 dist 9.44142 8.98908 8.23451 6.8533 10.1118 11.9434 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 7.9267 8.03092 5.65659 7.14918 5.98994 3.13463 numMergedOcc 0
18 mol 239 unq 1 iso 0 dist 7.9267 8.03092 5.65659 9.29322 11.6074 11.0087 numMergedOcc 0
19 mol 258 unq 0 iso 0 dist 6.27699 5.8804 3.34873 6.92906 5.7139 3.04079 numMergedOcc 0
20 mol 258 unq 1 iso 0 dist 6.27699 5.8804 3.34873 5.57978 4.05528 6.41309 numMergedOcc 0
