0 mol 43 unq 0 iso 0 dist 5.87251 6.75521 6.11363 10.3283 9.16827 13.8936 numMergedOcc 0
1 mol 51 unq 0 iso 0 dist 9.53744 8.92175 4.50391 6.57102 7.7625 10.2245 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 9.28709 8.63204 15.5707 9.17087 7.95122 17.5432 numMergedOcc 0
3 mol 70 unq 1 iso 0 dist 9.28709 8.63204 15.5707 5.33532 9.74268 13.3074 numMergedOcc 0
4 mol 70 unq 2 iso 0 dist 9.28709 5.4014 10.7012 9.17087 7.95122 13.7011 numMergedOcc 0
5 mol 70 unq 3 iso 0 dist 9.28709 5.4014 10.7012 5.33532 9.74268 10.4272 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 8.74797 6.62354 4.71888 16.863 8.91837 11.2828 numMergedOcc 0
7 mol 122 unq 0 iso 0 dist 6.12598 6.91978 5.69357 5.24418 7.43775 11.0694 numMergedOcc 0
8 mol 122 unq 1 iso 0 dist 6.12598 6.91978 5.69357 9.66073 8.09594 13.0148 numMergedOcc 0
9 mol 160 unq 0 iso 0 dist 9.5 8.27864 14.0318 11.1642 9.20228 18.3718 numMergedOcc 0
10 mol 214 unq 0 iso 0 dist 8.61758 6.28826 11.6354 4.7088 8.3035 10.6947 numMergedOcc 0
11 mol 214 unq 1 iso 0 dist 5.45548 6.28826 6.3054 4.7088 9.01896 10.6947 numMergedOcc 0
12 mol 248 unq 0 iso 0 dist 8.2748 5.65458 6.29802 6.86606 8.34646 10.6091 numMergedOcc 0
13 mol 250 unq 0 iso 0 dist 8.06649 8.51613 4.21309 6.15778 6.18342 6.59244 numMergedOcc 0
14 mol 253 unq 0 iso 0 dist 5.85222 9.08259 10.7913 12.3321 7.0247 16.453 numMergedOcc 0
15 mol 253 unq 1 iso 0 dist 5.85222 8.42325 5.9617 12.3321 7.0247 10.7613 numMergedOcc 0
16 mol 292 unq 0 iso 0 dist 8.76413 7.48212 4.54051 5.0721 5.69465 7.20674 numMergedOcc 0
