0 mol 15 unq 0 iso 0 dist 7.87072 6.19695 4.47278 7.16107 9.97769 5.7147 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 7.19406 7.12713 9.83606 6.51519 7.57749 5.4713 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 7.55854 9.29102 3.60325 4.27513 5.41774 8.29196 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 5.48669 8.30446 3.60325 4.78298 5.41774 8.29196 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 6.49446 6.0827 6.13411 5.06459 7.30651 8.93807 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 9.0101 8.26805 9.68005 4.05111 6.63973 5.45099 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 9.0101 9.68577 14.6547 4.05111 6.63973 8.44765 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 7.18358 6.29801 5.73969 6.06978 7.58743 9.21761 numMergedOcc 0
8 mol 81 unq 0 iso 0 dist 6.03428 7.94697 7.93947 8.57407 13.4084 8.96045 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 9.04398 6.38269 8.81921 7.6316 15.8205 8.67025 numMergedOcc 0
10 mol 113 unq 1 iso 0 dist 9.04398 7.11196 6.384 12.7927 12.7974 9.60127 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 8.08733 6.66313 3.80816 4.85157 5.90003 4.55071 numMergedOcc 0
12 mol 119 unq 1 iso 0 dist 4.90449 6.3646 3.80816 5.74561 5.90003 4.55071 numMergedOcc 0
13 mol 120 unq 0 iso 0 dist 9.35529 7.64841 3.71884 7.24685 10.7222 9.98772 numMergedOcc 0
14 mol 169 unq 0 iso 0 dist 6.57161 9.3206 7.16323 9.997 12.5739 7.65903 numMergedOcc 0
15 mol 171 unq 0 iso 0 dist 7.7195 6.80203 11.244 4.91613 6.51523 9.68512 numMergedOcc 0
16 mol 171 unq 1 iso 0 dist 9.43988 6.80203 5.58661 4.91613 12.263 9.68512 numMergedOcc 0
17 mol 171 unq 2 iso 0 dist 8.30819 8.00826 11.244 4.61696 6.51523 9.68512 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 9.75853 8.19926 8.26669 14.4294 17.1511 8.92135 numMergedOcc 0
19 mol 264 unq 0 iso 0 dist 5.03174 8.26228 5.51231 4.66338 7.19658 9.87744 numMergedOcc 0
