0 mol 11 unq 0 iso 0 dist 6.58046 7.85924 5.25331 6.35398 6.51674 9.09091 10.7048 6.83186 3.66215 9.81983 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 7.15542 4.84988 8.44353 11.8552 11.6319 7.34031 11.7316 14.8981 7.13338 6.28603 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 7.15542 4.84988 8.44353 11.8552 11.6319 7.34031 12.6801 16.5858 8.64653 8.80303 numMergedOcc 0
3 mol 48 unq 2 iso 0 dist 7.15542 4.84988 8.44353 11.8552 11.6319 7.34031 6.88863 8.22812 4.28224 7.11491 numMergedOcc 0
4 mol 48 unq 3 iso 0 dist 8.89047 4.84988 6.11249 11.8552 5.39812 7.34031 11.7316 9.83205 7.13338 6.28603 numMergedOcc 0
5 mol 48 unq 4 iso 0 dist 8.89047 4.84988 6.11249 11.8552 5.39812 7.34031 12.6801 11.444 8.64653 8.80303 numMergedOcc 0
6 mol 48 unq 5 iso 0 dist 8.89047 4.84988 6.11249 11.8552 5.39812 7.34031 6.88863 4.22002 4.28224 7.11491 numMergedOcc 0
7 mol 48 unq 6 iso 0 dist 8.89003 4.84988 7.86326 11.8552 8.55482 7.34031 11.7316 12.8664 7.13338 6.28603 numMergedOcc 0
8 mol 48 unq 7 iso 0 dist 8.89003 4.84988 7.86326 11.8552 8.55482 7.34031 12.6801 14.2734 8.64653 8.80303 numMergedOcc 0
9 mol 48 unq 8 iso 0 dist 8.89003 4.84988 7.86326 11.8552 8.55482 7.34031 6.88863 5.77855 4.28224 7.11491 numMergedOcc 0
10 mol 79 unq 0 iso 0 dist 5.25027 7.50972 7.90338 8.77598 5.25584 7.87237 13.7996 12.5398 8.42733 8.33791 numMergedOcc 0
11 mol 79 unq 1 iso 0 dist 5.25027 7.50972 7.90338 8.77598 5.25584 7.87237 8.95695 9.56766 4.89844 7.38548 numMergedOcc 0
12 mol 79 unq 2 iso 0 dist 5.25027 7.50972 7.90338 8.77598 5.25584 7.87237 12.9366 10.5782 6.58977 8.2992 numMergedOcc 0
13 mol 79 unq 3 iso 0 dist 5.25027 7.50972 7.90338 8.77598 5.25584 7.87237 3.83059 4.15789 4.35906 6.72546 numMergedOcc 0
14 mol 79 unq 4 iso 0 dist 4.37025 7.50972 7.08462 8.77598 5.79629 7.87237 13.7996 10.5441 8.42733 8.33791 numMergedOcc 0
15 mol 79 unq 5 iso 0 dist 4.37025 7.50972 7.08462 8.77598 5.79629 7.87237 8.95695 6.20144 4.89844 7.38548 numMergedOcc 0
16 mol 79 unq 6 iso 0 dist 4.37025 7.50972 7.08462 8.77598 5.79629 7.87237 12.9366 11.4924 6.58977 8.2992 numMergedOcc 0
17 mol 79 unq 7 iso 0 dist 4.37025 7.50972 7.08462 8.77598 5.79629 7.87237 3.83059 4.808 4.35906 6.72546 numMergedOcc 0
18 mol 85 unq 0 iso 0 dist 7.69926 10.7963 5.61151 11.5566 5.22259 6.05495 6.35602 6.67137 10.803 8.04853 numMergedOcc 0
19 mol 85 unq 1 iso 0 dist 7.69926 10.7963 5.61151 11.5566 5.22259 6.05495 10.4165 8.49871 7.59464 6.46549 numMergedOcc 0
20 mol 85 unq 2 iso 0 dist 5.85237 10.7963 6.54289 11.5566 7.66499 6.05495 6.35602 7.04244 10.803 8.04853 numMergedOcc 0
21 mol 85 unq 3 iso 0 dist 5.85237 10.7963 6.54289 11.5566 7.66499 6.05495 10.4165 9.59497 7.59464 6.46549 numMergedOcc 0
22 mol 85 unq 4 iso 0 dist 9.11768 7.79293 6.54289 10.8523 7.66499 6.05495 10.5854 7.04244 10.803 8.04853 numMergedOcc 0
23 mol 85 unq 5 iso 0 dist 9.11768 7.79293 6.54289 10.8523 7.66499 6.05495 6.64415 9.59497 7.59464 6.46549 numMergedOcc 0
24 mol 141 unq 0 iso 0 dist 9.3273 4.29204 9.68074 9.87644 5.16197 8.00449 6.80544 5.60448 9.53687 9.62774 numMergedOcc 0
25 mol 143 unq 0 iso 0 dist 8.99891 5.44503 8.08798 9.14266 4.5497 9.30424 6.75249 4.3855 4.19541 7.2932 numMergedOcc 0
26 mol 287 unq 0 iso 0 dist 9.18744 4.62998 7.77225 8.91712 3.96271 5.59555 13.2948 12.9723 8.99193 9.25759 numMergedOcc 0
27 mol 287 unq 1 iso 0 dist 5.30118 7.23534 5.50067 9.65934 5.39801 5.59555 3.65199 4.68668 8.99193 9.25759 numMergedOcc 0
28 mol 287 unq 2 iso 0 dist 8.98698 11.7115 5.50067 14.0537 5.39801 5.59555 5.70614 4.68668 8.99193 9.25759 numMergedOcc 0
29 mol 288 unq 0 iso 0 dist 9.18744 4.62998 7.77225 8.91712 3.96271 5.59555 13.2948 12.9723 8.99193 9.25759 numMergedOcc 0
30 mol 288 unq 1 iso 0 dist 5.30118 7.23534 5.50067 9.65934 5.39801 5.59555 3.65199 4.68668 8.99193 9.25759 numMergedOcc 0
31 mol 288 unq 2 iso 0 dist 8.98698 11.7115 5.50067 14.0537 5.39801 5.59555 5.70614 4.68668 8.99193 9.25759 numMergedOcc 0
32 mol 289 unq 0 iso 0 dist 9.18744 4.62998 7.77225 8.91712 3.96271 5.59555 13.2948 12.9723 8.99193 9.25759 numMergedOcc 0
33 mol 289 unq 1 iso 0 dist 5.30118 7.23534 5.50067 9.65934 5.39801 5.59555 3.65199 4.68668 8.99193 9.25759 numMergedOcc 0
34 mol 289 unq 2 iso 0 dist 8.98698 11.7115 5.50067 14.0537 5.39801 5.59555 5.70614 4.68668 8.99193 9.25759 numMergedOcc 0
35 mol 292 unq 0 iso 0 dist 9.96374 12.1551 3.93401 14.0184 4.30125 5.7131 22.3042 12.6751 11.1017 9.373 numMergedOcc 0
