0 mol 54 unq 0 iso 0 dist 8.62769 9.80109 5.38191 5.17091 7.16132 5.60003 numMergedOcc 0
1 mol 54 unq 1 iso 0 dist 6.09782 8.65318 5.38191 10.763 7.16132 5.60003 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 8.54845 12.3451 6.80741 5.37928 9.2898 14.8094 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 6.46655 6.55138 6.48625 9.85425 6.56212 11.1377 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 8.46734 11.6409 8.21889 4.57343 6.29161 10.4255 numMergedOcc 0
5 mol 109 unq 1 iso 0 dist 8.46734 11.6409 8.21889 11.3914 7.86666 14.5244 numMergedOcc 0
6 mol 109 unq 2 iso 0 dist 7.4371 5.74375 6.31633 5.28562 9.77497 6.54844 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 5.97879 4.45081 8.64783 5.33859 5.7144 4.62699 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 7.73139 14.0161 8.40046 4.66329 6.08673 12.1959 numMergedOcc 0
9 mol 127 unq 1 iso 0 dist 6.66607 6.39358 8.40046 7.30158 6.08673 12.1959 numMergedOcc 0
10 mol 127 unq 2 iso 0 dist 8.62711 15.8417 8.40046 9.74982 6.08673 12.1959 numMergedOcc 0
11 mol 182 unq 0 iso 0 dist 9.36307 4.39505 7.86625 5.62883 9.56028 4.82437 numMergedOcc 0
12 mol 214 unq 0 iso 0 dist 9.40003 10.6403 8.49704 7.66602 7.46481 4.112 numMergedOcc 0
13 mol 214 unq 1 iso 0 dist 8.68385 15.7236 8.49704 15.5553 7.46481 4.112 numMergedOcc 0
14 mol 222 unq 0 iso 0 dist 7.27481 4.56782 8.7347 12.9462 6.74196 15.1289 numMergedOcc 0
15 mol 222 unq 1 iso 0 dist 7.27481 4.56782 8.7347 9.50604 8.36842 13.6078 numMergedOcc 0
16 mol 222 unq 2 iso 0 dist 7.27481 4.56782 8.7347 9.68195 9.75472 13.6261 numMergedOcc 0
17 mol 276 unq 0 iso 0 dist 5.30976 4.48428 9.05218 3.87012 8.6759 5.58312 numMergedOcc 0
18 mol 285 unq 0 iso 0 dist 7.66291 12.6654 8.71213 10.9224 7.80862 13.9922 numMergedOcc 0
