0 mol 5 unq 0 iso 0 dist 6.84403 9.86592 7.74636 15.3933 11.6519 7.44029 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 9.76233 7.86632 9.89425 12.5116 9.80646 6.50001 numMergedOcc 0
2 mol 13 unq 0 iso 0 dist 8.66515 10.3134 8.27119 12.4916 10.6761 4.43066 numMergedOcc 0
3 mol 13 unq 1 iso 0 dist 9.48239 10.4917 8.27119 14.8748 10.6761 4.43066 numMergedOcc 0
4 mol 15 unq 0 iso 0 dist 6.19695 7.16107 5.7147 7.87072 4.47278 9.97769 numMergedOcc 0
5 mol 46 unq 0 iso 0 dist 7.12713 6.51519 5.4713 7.19406 9.83606 7.57749 numMergedOcc 0
6 mol 46 unq 1 iso 0 dist 7.12713 6.51519 5.4713 14.4357 8.99132 8.55202 numMergedOcc 0
7 mol 48 unq 0 iso 0 dist 9.29102 4.27513 8.29196 7.55854 3.60325 5.41774 numMergedOcc 0
8 mol 48 unq 1 iso 0 dist 8.30446 4.78298 8.29196 5.48669 3.60325 5.41774 numMergedOcc 0
9 mol 59 unq 0 iso 0 dist 4.74574 4.80894 6.23509 12.1671 12.2062 9.01601 numMergedOcc 0
10 mol 62 unq 0 iso 0 dist 6.0827 5.06459 8.93807 6.49446 6.13411 7.30651 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 8.26805 4.05111 5.45099 9.0101 9.68005 6.63973 numMergedOcc 0
12 mol 76 unq 1 iso 0 dist 9.68577 4.05111 8.44765 9.0101 14.6547 6.63973 numMergedOcc 0
13 mol 79 unq 0 iso 0 dist 6.29801 6.06978 9.21761 7.18358 5.73969 7.58743 numMergedOcc 0
14 mol 79 unq 1 iso 0 dist 8.39378 10.2073 9.21761 10.4868 5.73969 7.58743 numMergedOcc 0
15 mol 81 unq 0 iso 0 dist 7.94697 8.57407 8.96045 11.6737 5.82911 8.38883 numMergedOcc 0
16 mol 119 unq 0 iso 0 dist 6.66313 4.85157 4.55071 8.08733 3.80816 5.90003 numMergedOcc 0
17 mol 119 unq 1 iso 0 dist 6.3646 5.74561 4.55071 4.90449 3.80816 5.90003 numMergedOcc 0
18 mol 169 unq 0 iso 0 dist 6.18165 14.017 8.6961 9.10097 4.24401 6.00783 numMergedOcc 0
19 mol 171 unq 0 iso 0 dist 6.80203 4.91613 9.68512 7.7195 11.244 6.51523 numMergedOcc 0
20 mol 171 unq 1 iso 0 dist 8.00826 4.61696 9.68512 8.30819 11.244 6.51523 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 8.89804 14.2573 9.34653 19.6202 12.7948 6.52441 numMergedOcc 0
22 mol 257 unq 0 iso 0 dist 8.50916 10.4413 7.80473 11.3587 5.73371 8.70029 numMergedOcc 0
23 mol 264 unq 0 iso 0 dist 8.26228 4.66338 9.87744 13.0943 14.0586 9.13546 numMergedOcc 0
24 mol 264 unq 1 iso 0 dist 8.26228 4.66338 9.87744 5.03174 5.51231 7.19658 numMergedOcc 0
25 mol 279 unq 0 iso 0 dist 9.98334 8.66839 4.98693 16.2607 9.78358 8.41945 numMergedOcc 0
