0 mol 25 unq 0 iso 0 dist 8.46842 13.3513 7.57578 14.4516 7.17969 4.33106 5.03904 4.79873 10.2864 11.4148 numMergedOcc 0
1 mol 25 unq 0 iso 1 dist 8.46842 14.4516 7.17969 13.3513 7.57578 4.33106 5.03904 4.79873 11.4148 10.2864 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 8.46842 13.3513 7.57578 14.4516 7.17969 4.33106 16.8735 9.48085 5.18617 5.68041 numMergedOcc 0
3 mol 25 unq 1 iso 1 dist 8.46842 14.4516 7.17969 13.3513 7.57578 4.33106 16.8735 9.48085 5.68041 5.18617 numMergedOcc 0
4 mol 45 unq 0 iso 0 dist 6.96797 5.84852 7.2846 6.5822 7.58835 8.81358 4.4519 9.33906 6.42339 5.1274 numMergedOcc 0
5 mol 45 unq 0 iso 1 dist 6.96797 6.5822 7.58835 5.84852 7.2846 8.81358 4.4519 9.33906 5.1274 6.42339 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 6.47132 9.86595 7.17396 10.2137 9.21998 6.05545 6.13703 6.56212 7.31539 11.1607 numMergedOcc 0
7 mol 59 unq 0 iso 1 dist 6.47132 10.2137 9.21998 9.86595 7.17396 6.05545 6.13703 6.56212 11.1607 7.31539 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 6.5136 7.08612 7.27724 11.085 8.03644 8.41707 5.9335 9.3948 3.94537 11.3215 numMergedOcc 0
9 mol 95 unq 0 iso 1 dist 6.5136 11.085 8.03644 7.08612 7.27724 8.41707 5.9335 9.3948 11.3215 3.94537 numMergedOcc 0
10 mol 95 unq 1 iso 0 dist 6.5136 7.08612 7.27724 11.085 8.03644 8.41707 9.88003 9.74607 6.12605 5.06946 numMergedOcc 0
11 mol 95 unq 1 iso 1 dist 6.5136 11.085 8.03644 7.08612 7.27724 8.41707 9.88003 9.74607 5.06946 6.12605 numMergedOcc 0
12 mol 117 unq 0 iso 0 dist 8.98848 14.6144 7.90328 10.0436 7.83136 7.22206 10.1153 8.84018 7.20875 3.77029 numMergedOcc 0
13 mol 117 unq 0 iso 1 dist 8.98848 10.0436 7.83136 14.6144 7.90328 7.22206 10.1153 8.84018 3.77029 7.20875 numMergedOcc 0
14 mol 117 unq 1 iso 0 dist 8.98848 14.6144 7.90328 6.81312 7.0603 9.3584 10.1153 8.84018 7.20875 5.21535 numMergedOcc 0
15 mol 117 unq 1 iso 1 dist 8.98848 6.81312 7.0603 14.6144 7.90328 9.3584 10.1153 8.84018 5.21535 7.20875 numMergedOcc 0
16 mol 117 unq 1 iso 0 dist 8.98848 10.0436 7.83136 6.81312 7.0603 7.21564 10.1153 8.84018 3.77029 5.21535 numMergedOcc 0
17 mol 117 unq 1 iso 1 dist 8.98848 6.81312 7.0603 10.0436 7.83136 7.21564 10.1153 8.84018 5.21535 3.77029 numMergedOcc 0
18 mol 133 unq 0 iso 0 dist 7.85025 4.26332 6.29155 11.5948 6.80239 7.81217 13.4842 8.77023 13.0405 13.7612 numMergedOcc 0
19 mol 133 unq 0 iso 1 dist 7.85025 11.5948 6.80239 4.26332 6.29155 7.81217 13.4842 8.77023 13.7612 13.0405 numMergedOcc 0
20 mol 133 unq 1 iso 0 dist 7.85025 4.26332 6.29155 13.8058 8.00618 11.965 13.4842 8.77023 13.0405 15.0115 numMergedOcc 0
21 mol 133 unq 1 iso 1 dist 7.85025 13.8058 8.00618 4.26332 6.29155 11.965 13.4842 8.77023 15.0115 13.0405 numMergedOcc 0
22 mol 133 unq 1 iso 0 dist 7.85025 11.5948 6.80239 13.8058 8.00618 7.79672 13.4842 8.77023 13.7612 15.0115 numMergedOcc 0
23 mol 133 unq 1 iso 1 dist 7.85025 13.8058 8.00618 11.5948 6.80239 7.79672 13.4842 8.77023 15.0115 13.7612 numMergedOcc 0
24 mol 204 unq 0 iso 0 dist 9.65951 11.5989 7.10633 9.99471 8.51516 10.8344 4.51957 7.9133 10.7169 5.57347 numMergedOcc 0
25 mol 204 unq 0 iso 1 dist 9.65951 9.99471 8.51516 11.5989 7.10633 10.8344 4.51957 7.9133 5.57347 10.7169 numMergedOcc 0
26 mol 204 unq 1 iso 0 dist 9.14829 6.73339 7.10633 13.2127 8.51516 10.8344 9.9552 7.9133 10.7169 5.57347 numMergedOcc 0
27 mol 204 unq 1 iso 1 dist 9.14829 13.2127 8.51516 6.73339 7.10633 10.8344 9.9552 7.9133 5.57347 10.7169 numMergedOcc 0
28 mol 214 unq 0 iso 0 dist 9.33638 15.9383 9.65138 7.31241 7.14453 9.10746 10.2403 7.46481 11.4955 8.459 numMergedOcc 0
29 mol 214 unq 0 iso 1 dist 9.33638 7.31241 7.14453 15.9383 9.65138 9.10746 10.2403 7.46481 8.459 11.4955 numMergedOcc 0
30 mol 214 unq 1 iso 0 dist 9.33638 15.9383 9.65138 17.0758 8.85478 4.40923 10.2403 7.46481 11.4955 11.1534 numMergedOcc 0
31 mol 214 unq 1 iso 1 dist 9.33638 17.0758 8.85478 15.9383 9.65138 4.40923 10.2403 7.46481 11.1534 11.4955 numMergedOcc 0
32 mol 214 unq 1 iso 0 dist 9.33638 7.31241 7.14453 17.0758 8.85478 11.3796 10.2403 7.46481 8.459 11.1534 numMergedOcc 0
33 mol 214 unq 1 iso 1 dist 9.33638 17.0758 8.85478 7.31241 7.14453 11.3796 10.2403 7.46481 11.1534 8.459 numMergedOcc 0
34 mol 229 unq 0 iso 0 dist 9.68636 10.705 8.22528 5.6419 7.03423 5.57838 9.76444 7.27993 5.70473 7.22525 numMergedOcc 0
35 mol 229 unq 0 iso 1 dist 9.68636 5.6419 7.03423 10.705 8.22528 5.57838 9.76444 7.27993 7.22525 5.70473 numMergedOcc 0
36 mol 234 unq 0 iso 0 dist 7.17987 14.7629 9.45496 13.5847 6.7625 7.82322 12.4759 7.81215 12.4252 5.75498 numMergedOcc 0
37 mol 234 unq 0 iso 1 dist 7.17987 13.5847 6.7625 14.7629 9.45496 7.82322 12.4759 7.81215 5.75498 12.4252 numMergedOcc 0
38 mol 238 unq 0 iso 0 dist 9.09166 6.74773 6.22714 9.48707 7.31233 5.34096 17.7087 9.08509 12.7938 11.0772 numMergedOcc 0
39 mol 238 unq 0 iso 1 dist 9.09166 9.48707 7.31233 6.74773 6.22714 5.34096 17.7087 9.08509 11.0772 12.7938 numMergedOcc 0
40 mol 276 unq 0 iso 0 dist 6.97104 12.2532 9.8993 5.58984 6.87396 6.88557 9.98339 8.6759 9.39944 8.26321 numMergedOcc 0
41 mol 276 unq 0 iso 1 dist 6.97104 5.58984 6.87396 12.2532 9.8993 6.88557 9.98339 8.6759 8.26321 9.39944 numMergedOcc 0
42 mol 276 unq 1 iso 0 dist 8.63281 12.388 9.8993 6.58819 6.87396 6.88557 7.37489 8.6759 9.39944 8.26321 numMergedOcc 0
43 mol 276 unq 1 iso 1 dist 8.63281 6.58819 6.87396 12.388 9.8993 6.88557 7.37489 8.6759 8.26321 9.39944 numMergedOcc 0
