0 mol 10 unq 0 iso 0 dist 9.38676 9.81159 9.23414 9.85471 9.97671 4.55975 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 9.38676 9.81159 9.23414 5.42516 7.83087 11.8229 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 9.38676 9.81159 9.23414 6.29173 9.37129 6.16158 numMergedOcc 0
3 mol 11 unq 0 iso 0 dist 7.85585 11.682 9.07476 4.86239 5.47299 9.89387 numMergedOcc 0
4 mol 11 unq 1 iso 0 dist 7.92563 11.4541 9.04534 4.99301 5.40468 9.85415 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 9.75794 14.8363 7.25138 11.7111 7.01397 11.1544 numMergedOcc 0
6 mol 88 unq 0 iso 0 dist 8.84468 8.38946 9.40699 8.729 8.73208 12.0479 numMergedOcc 0
7 mol 88 unq 1 iso 0 dist 8.84468 8.38946 9.40699 5.30982 5.60174 9.40927 numMergedOcc 0
8 mol 93 unq 0 iso 0 dist 9.90891 7.74883 5.10693 5.07809 8.24402 4.1947 numMergedOcc 0
9 mol 169 unq 0 iso 0 dist 7.5669 9.19866 7.78577 4.92117 6.27378 11.8115 numMergedOcc 0
10 mol 232 unq 0 iso 0 dist 8.78026 4.26087 9.4726 8.88648 5.86945 11.8349 numMergedOcc 0
11 mol 232 unq 1 iso 0 dist 8.78026 13.0798 8.32831 8.88648 5.86945 4.44276 numMergedOcc 0
12 mol 232 unq 2 iso 0 dist 8.78026 9.56948 7.91213 8.88648 5.86945 4.31175 numMergedOcc 0
13 mol 232 unq 3 iso 0 dist 8.78026 8.43971 9.33969 8.88648 5.86945 9.07946 numMergedOcc 0
14 mol 268 unq 0 iso 0 dist 7.93928 4.51589 6.18877 9.85316 9.06348 10.5447 numMergedOcc 0
15 mol 270 unq 0 iso 0 dist 7.70593 14.2231 8.76202 12.1238 9.47295 7.74086 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 5.99705 13.6326 8.72101 13.136 9.07744 13.3688 numMergedOcc 0
17 mol 277 unq 1 iso 0 dist 5.99705 13.6326 8.72101 6.02765 8.42892 16.9673 numMergedOcc 0
18 mol 277 unq 2 iso 0 dist 5.99705 13.6326 8.72101 10.0826 8.90967 8.45252 numMergedOcc 0
19 mol 277 unq 3 iso 0 dist 5.99705 4.82882 5.11998 13.136 9.07744 12.5633 numMergedOcc 0
20 mol 277 unq 4 iso 0 dist 5.99705 4.82882 5.11998 6.02765 8.42892 5.10572 numMergedOcc 0
21 mol 277 unq 5 iso 0 dist 5.99705 4.82882 5.11998 10.0826 8.90967 12.1971 numMergedOcc 0
22 mol 277 unq 6 iso 0 dist 5.04543 13.6326 8.75619 10.0826 6.40861 8.45252 numMergedOcc 0
23 mol 277 unq 7 iso 0 dist 5.04543 4.82882 5.79925 10.0826 6.40861 12.1971 numMergedOcc 0
24 mol 277 unq 8 iso 0 dist 5.04543 7.5495 8.55906 10.0826 6.40861 8.18751 numMergedOcc 0
25 mol 277 unq 9 iso 0 dist 5.04543 9.16695 5.55523 10.0826 6.40861 6.94318 numMergedOcc 0
26 mol 277 unq 10 iso 0 dist 8.99501 17.0068 8.75619 11.0062 6.40861 8.45252 numMergedOcc 0
27 mol 277 unq 11 iso 0 dist 8.99501 10.4709 5.79925 11.0062 6.40861 12.1971 numMergedOcc 0
28 mol 277 unq 12 iso 0 dist 8.99501 5.08958 8.55906 11.0062 6.40861 8.18751 numMergedOcc 0
29 mol 277 unq 13 iso 0 dist 8.99501 9.02911 5.55523 11.0062 6.40861 6.94318 numMergedOcc 0
30 mol 281 unq 0 iso 0 dist 7.55248 13.9262 6.82918 8.93324 9.39268 14.9508 numMergedOcc 0
31 mol 281 unq 1 iso 0 dist 7.55248 13.9262 6.82918 15.2477 9.06888 4.19307 numMergedOcc 0
32 mol 281 unq 2 iso 0 dist 6.50041 9.83564 6.82918 13.4253 9.39268 14.9508 numMergedOcc 0
33 mol 281 unq 3 iso 0 dist 6.50041 9.83564 6.82918 11.0397 9.06888 4.19307 numMergedOcc 0
34 mol 281 unq 4 iso 0 dist 5.70591 8.53439 9.13909 11.0397 6.62682 8.64726 numMergedOcc 0
35 mol 281 unq 5 iso 0 dist 5.70591 9.83564 4.29351 11.0397 6.62682 4.19307 numMergedOcc 0
