0 mol 19 unq 0 iso 0 dist 6.41045 13.3276 8.4674 7.64353 4.51865 5.80928 10.26 6.20943 5.14627 4.69858 10.4834 8.40416 9.74255 7.08342 11.4087 numMergedOcc 0
1 mol 19 unq 0 iso 1 dist 6.41045 7.64353 4.51865 13.3276 8.4674 5.80928 10.26 6.20943 4.69858 5.14627 10.4834 8.40416 7.08342 9.74255 11.4087 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.03754 14.0204 8.80331 13.1056 6.20293 8.13395 10.1053 9.83618 10.4442 9.49077 11.3298 8.95682 6.18002 8.38399 4.54282 numMergedOcc 0
3 mol 43 unq 0 iso 1 dist 8.03754 13.1056 6.20293 14.0204 8.80331 8.13395 10.1053 9.83618 9.49077 10.4442 11.3298 8.95682 8.38399 6.18002 4.54282 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 9.83775 13.0222 7.71095 5.82428 8.84665 12.5396 9.25208 8.24062 5.3525 11.0387 3.85789 6.73347 9.64444 4.36133 7.0313 numMergedOcc 0
5 mol 59 unq 0 iso 1 dist 9.83775 5.82428 8.84665 13.0222 7.71095 12.5396 9.25208 8.24062 11.0387 5.3525 3.85789 6.73347 4.36133 9.64444 7.0313 numMergedOcc 0
6 mol 59 unq 1 iso 0 dist 9.83775 13.0222 7.71095 10.1226 8.25513 8.19458 9.25208 8.24062 5.3525 9.15805 3.85789 6.73347 9.64444 6.66692 7.0313 numMergedOcc 0
7 mol 59 unq 1 iso 1 dist 9.83775 10.1226 8.25513 13.0222 7.71095 8.19458 9.25208 8.24062 9.15805 5.3525 3.85789 6.73347 6.66692 9.64444 7.0313 numMergedOcc 0
8 mol 59 unq 1 iso 0 dist 9.83775 5.82428 8.84665 10.1226 8.25513 6.40295 9.25208 8.24062 11.0387 9.15805 3.85789 6.73347 4.36133 6.66692 7.0313 numMergedOcc 0
9 mol 59 unq 1 iso 1 dist 9.83775 10.1226 8.25513 5.82428 8.84665 6.40295 9.25208 8.24062 9.15805 11.0387 3.85789 6.73347 6.66692 4.36133 7.0313 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 7.11695 14.4144 9.33898 9.54167 9.64443 13.1316 6.85223 8.36431 10.9701 12.4284 4.92054 8.91313 17.5889 13.3881 10.2475 numMergedOcc 0
11 mol 92 unq 0 iso 1 dist 7.11695 9.54167 9.64443 14.4144 9.33898 13.1316 6.85223 8.36431 12.4284 10.9701 4.92054 8.91313 13.3881 17.5889 10.2475 numMergedOcc 0
12 mol 92 unq 1 iso 0 dist 7.11695 14.4144 9.33898 9.54167 9.64443 13.1316 6.85223 8.36431 10.9701 12.4284 6.7197 8.16392 10.8304 5.90097 6.94695 numMergedOcc 0
13 mol 92 unq 1 iso 1 dist 7.11695 9.54167 9.64443 14.4144 9.33898 13.1316 6.85223 8.36431 12.4284 10.9701 6.7197 8.16392 5.90097 10.8304 6.94695 numMergedOcc 0
14 mol 100 unq 0 iso 0 dist 7.689 14.9329 9.60661 5.71475 7.17106 11.5403 4.71183 6.58204 10.9608 5.01145 12.5859 7.01812 5.80144 8.4128 10.0891 numMergedOcc 0
15 mol 100 unq 0 iso 1 dist 7.689 5.71475 7.17106 14.9329 9.60661 11.5403 4.71183 6.58204 5.01145 10.9608 12.5859 7.01812 8.4128 5.80144 10.0891 numMergedOcc 0
16 mol 100 unq 1 iso 0 dist 7.689 14.9329 9.60661 10.3954 9.35224 7.80879 4.71183 6.58204 10.9608 5.69137 12.5859 7.01812 5.80144 10.0456 10.0891 numMergedOcc 0
17 mol 100 unq 1 iso 1 dist 7.689 10.3954 9.35224 14.9329 9.60661 7.80879 4.71183 6.58204 5.69137 10.9608 12.5859 7.01812 10.0456 5.80144 10.0891 numMergedOcc 0
18 mol 100 unq 1 iso 0 dist 7.689 5.71475 7.17106 10.3954 9.35224 8.87654 4.71183 6.58204 5.01145 5.69137 12.5859 7.01812 8.4128 10.0456 10.0891 numMergedOcc 0
19 mol 100 unq 1 iso 1 dist 7.689 10.3954 9.35224 5.71475 7.17106 8.87654 4.71183 6.58204 5.69137 5.01145 12.5859 7.01812 10.0456 8.4128 10.0891 numMergedOcc 0
20 mol 100 unq 2 iso 0 dist 9.22737 12.9061 7.47343 6.60925 6.65086 8.8807 10.2716 7.75343 15.209 10.9608 10.6748 8.30845 12.2861 5.80144 10.0891 numMergedOcc 0
21 mol 100 unq 2 iso 1 dist 9.22737 6.60925 6.65086 12.9061 7.47343 8.8807 10.2716 7.75343 10.9608 15.209 10.6748 8.30845 5.80144 12.2861 10.0891 numMergedOcc 0
22 mol 100 unq 3 iso 0 dist 9.22737 12.9061 7.47343 6.60925 6.65086 8.8807 10.2716 7.75343 15.209 10.9608 9.64716 8.76378 15.5385 12.3577 4.44538 numMergedOcc 0
23 mol 100 unq 3 iso 1 dist 9.22737 6.60925 6.65086 12.9061 7.47343 8.8807 10.2716 7.75343 10.9608 15.209 9.64716 8.76378 12.3577 15.5385 4.44538 numMergedOcc 0
24 mol 100 unq 4 iso 0 dist 9.22737 12.9061 7.47343 4.95357 6.56369 12.6515 10.2716 7.75343 15.209 5.69137 10.6748 8.30845 12.2861 10.0456 10.0891 numMergedOcc 0
25 mol 100 unq 4 iso 1 dist 9.22737 4.95357 6.56369 12.9061 7.47343 12.6515 10.2716 7.75343 5.69137 15.209 10.6748 8.30845 10.0456 12.2861 10.0891 numMergedOcc 0
26 mol 100 unq 5 iso 0 dist 9.22737 12.9061 7.47343 4.95357 6.56369 12.6515 10.2716 7.75343 15.209 5.69137 9.64716 8.76378 15.5385 4.97045 4.44538 numMergedOcc 0
27 mol 100 unq 5 iso 1 dist 9.22737 4.95357 6.56369 12.9061 7.47343 12.6515 10.2716 7.75343 5.69137 15.209 9.64716 8.76378 4.97045 15.5385 4.44538 numMergedOcc 0
28 mol 100 unq 6 iso 0 dist 9.22737 12.9061 7.47343 5.05858 9.30209 13.887 10.2716 7.75343 15.209 9.21622 10.6748 8.30845 12.2861 6.70236 10.0891 numMergedOcc 0
29 mol 100 unq 6 iso 1 dist 9.22737 5.05858 9.30209 12.9061 7.47343 13.887 10.2716 7.75343 9.21622 15.209 10.6748 8.30845 6.70236 12.2861 10.0891 numMergedOcc 0
30 mol 100 unq 7 iso 0 dist 9.22737 12.9061 7.47343 5.05858 9.30209 13.887 10.2716 7.75343 15.209 9.21622 9.64716 8.76378 15.5385 10.7791 4.44538 numMergedOcc 0
31 mol 100 unq 7 iso 1 dist 9.22737 5.05858 9.30209 12.9061 7.47343 13.887 10.2716 7.75343 9.21622 15.209 9.64716 8.76378 10.7791 15.5385 4.44538 numMergedOcc 0
32 mol 100 unq 4 iso 0 dist 9.22737 6.60925 6.65086 4.95357 6.56369 7.80879 10.2716 7.75343 10.9608 5.69137 10.6748 8.30845 5.80144 10.0456 10.0891 numMergedOcc 0
33 mol 100 unq 4 iso 1 dist 9.22737 4.95357 6.56369 6.60925 6.65086 7.80879 10.2716 7.75343 5.69137 10.9608 10.6748 8.30845 10.0456 5.80144 10.0891 numMergedOcc 0
34 mol 100 unq 5 iso 0 dist 9.22737 6.60925 6.65086 4.95357 6.56369 7.80879 10.2716 7.75343 10.9608 5.69137 9.64716 8.76378 12.3577 4.97045 4.44538 numMergedOcc 0
35 mol 100 unq 5 iso 1 dist 9.22737 4.95357 6.56369 6.60925 6.65086 7.80879 10.2716 7.75343 5.69137 10.9608 9.64716 8.76378 4.97045 12.3577 4.44538 numMergedOcc 0
36 mol 100 unq 6 iso 0 dist 9.22737 6.60925 6.65086 5.05858 9.30209 5.38414 10.2716 7.75343 10.9608 9.21622 10.6748 8.30845 5.80144 6.70236 10.0891 numMergedOcc 0
37 mol 100 unq 6 iso 1 dist 9.22737 5.05858 9.30209 6.60925 6.65086 5.38414 10.2716 7.75343 9.21622 10.9608 10.6748 8.30845 6.70236 5.80144 10.0891 numMergedOcc 0
38 mol 100 unq 7 iso 0 dist 9.22737 6.60925 6.65086 5.05858 9.30209 5.38414 10.2716 7.75343 10.9608 9.21622 9.64716 8.76378 12.3577 10.7791 4.44538 numMergedOcc 0
39 mol 100 unq 7 iso 1 dist 9.22737 5.05858 9.30209 6.60925 6.65086 5.38414 10.2716 7.75343 9.21622 10.9608 9.64716 8.76378 10.7791 12.3577 4.44538 numMergedOcc 0
40 mol 100 unq 6 iso 0 dist 9.22737 4.95357 6.56369 5.05858 9.30209 6.39938 10.2716 7.75343 5.69137 9.21622 10.6748 8.30845 10.0456 6.70236 10.0891 numMergedOcc 0
41 mol 100 unq 6 iso 1 dist 9.22737 5.05858 9.30209 4.95357 6.56369 6.39938 10.2716 7.75343 9.21622 5.69137 10.6748 8.30845 6.70236 10.0456 10.0891 numMergedOcc 0
42 mol 100 unq 7 iso 0 dist 9.22737 4.95357 6.56369 5.05858 9.30209 6.39938 10.2716 7.75343 5.69137 9.21622 9.64716 8.76378 4.97045 10.7791 4.44538 numMergedOcc 0
43 mol 100 unq 7 iso 1 dist 9.22737 5.05858 9.30209 4.95357 6.56369 6.39938 10.2716 7.75343 9.21622 5.69137 9.64716 8.76378 10.7791 4.97045 4.44538 numMergedOcc 0
44 mol 134 unq 0 iso 0 dist 8.86784 5.15251 6.54501 6.65283 6.49416 5.00526 10.0815 8.6355 10.1448 5.41704 12.3839 7.80532 7.41674 9.87376 14.1488 numMergedOcc 0
45 mol 134 unq 0 iso 1 dist 8.86784 6.65283 6.49416 5.15251 6.54501 5.00526 10.0815 8.6355 5.41704 10.1448 12.3839 7.80532 9.87376 7.41674 14.1488 numMergedOcc 0
46 mol 204 unq 0 iso 0 dist 9.44947 10.5243 7.10633 10.2677 8.51516 10.8344 12.7783 5.90931 5.09262 12.9483 4.29037 9.68728 7.67571 10.8573 11.145 numMergedOcc 0
47 mol 204 unq 0 iso 1 dist 9.44947 10.2677 8.51516 10.5243 7.10633 10.8344 12.7783 5.90931 12.9483 5.09262 4.29037 9.68728 10.8573 7.67571 11.145 numMergedOcc 0
48 mol 205 unq 0 iso 0 dist 8.52924 7.17157 6.03031 11.993 7.26832 7.38516 15.3503 9.19704 8.66809 6.23291 5.63231 6.03688 8.15057 12.4957 14.6029 numMergedOcc 0
49 mol 205 unq 0 iso 1 dist 8.52924 11.993 7.26832 7.17157 6.03031 7.38516 15.3503 9.19704 6.23291 8.66809 5.63231 6.03688 12.4957 8.15057 14.6029 numMergedOcc 0
50 mol 205 unq 1 iso 0 dist 8.52924 7.17157 6.03031 9.67882 7.80463 8.18714 15.3503 9.19704 8.66809 13.231 5.63231 6.03688 8.15057 6.09749 14.6029 numMergedOcc 0
51 mol 205 unq 1 iso 1 dist 8.52924 9.67882 7.80463 7.17157 6.03031 8.18714 15.3503 9.19704 13.231 8.66809 5.63231 6.03688 6.09749 8.15057 14.6029 numMergedOcc 0
52 mol 205 unq 1 iso 0 dist 8.52924 11.993 7.26832 9.67882 7.80463 13.8543 15.3503 9.19704 6.23291 13.231 5.63231 6.03688 12.4957 6.09749 14.6029 numMergedOcc 0
53 mol 205 unq 1 iso 1 dist 8.52924 9.67882 7.80463 11.993 7.26832 13.8543 15.3503 9.19704 13.231 6.23291 5.63231 6.03688 6.09749 12.4957 14.6029 numMergedOcc 0
54 mol 234 unq 0 iso 0 dist 5.46736 4.82695 8.34494 4.93623 6.56247 6.29886 10.024 6.25105 10.3337 11.216 6.30638 9.81425 4.3717 4.46561 13.0631 numMergedOcc 0
55 mol 234 unq 0 iso 1 dist 5.46736 4.93623 6.56247 4.82695 8.34494 6.29886 10.024 6.25105 11.216 10.3337 6.30638 9.81425 4.46561 4.3717 13.0631 numMergedOcc 0
56 mol 234 unq 1 iso 0 dist 5.46736 4.82695 8.34494 11.7817 9.36357 12.1694 10.024 6.25105 10.3337 11.4315 6.30638 9.81425 4.3717 10.641 13.0631 numMergedOcc 0
57 mol 234 unq 1 iso 1 dist 5.46736 11.7817 9.36357 4.82695 8.34494 12.1694 10.024 6.25105 11.4315 10.3337 6.30638 9.81425 10.641 4.3717 13.0631 numMergedOcc 0
58 mol 234 unq 1 iso 0 dist 5.46736 4.93623 6.56247 11.7817 9.36357 7.82322 10.024 6.25105 11.216 11.4315 6.30638 9.81425 4.46561 10.641 13.0631 numMergedOcc 0
59 mol 234 unq 1 iso 1 dist 5.46736 11.7817 9.36357 4.93623 6.56247 7.82322 10.024 6.25105 11.4315 11.216 6.30638 9.81425 10.641 4.46561 13.0631 numMergedOcc 0
60 mol 249 unq 0 iso 0 dist 6.26142 5.59015 7.57994 4.77325 6.18582 5.01979 10.0505 8.83735 5.23473 7.38675 9.55793 5.48118 10.7772 7.04666 10.639 numMergedOcc 0
61 mol 249 unq 0 iso 1 dist 6.26142 4.77325 6.18582 5.59015 7.57994 5.01979 10.0505 8.83735 7.38675 5.23473 9.55793 5.48118 7.04666 10.7772 10.639 numMergedOcc 0
62 mol 282 unq 0 iso 0 dist 7.71088 5.86383 8.04483 11.2986 8.76532 10.0156 6.7858 8.8673 10.1236 8.14825 4.90579 9.0975 5.65568 8.12478 5.50768 numMergedOcc 0
63 mol 282 unq 0 iso 1 dist 7.71088 11.2986 8.76532 5.86383 8.04483 10.0156 6.7858 8.8673 8.14825 10.1236 4.90579 9.0975 8.12478 5.65568 5.50768 numMergedOcc 0
64 mol 282 unq 1 iso 0 dist 7.71088 5.86383 8.04483 7.46064 6.33524 5.39891 6.7858 8.8673 10.1236 7.36881 4.90579 9.0975 5.65568 5.0324 5.50768 numMergedOcc 0
65 mol 282 unq 1 iso 1 dist 7.71088 7.46064 6.33524 5.86383 8.04483 5.39891 6.7858 8.8673 7.36881 10.1236 4.90579 9.0975 5.0324 5.65568 5.50768 numMergedOcc 0
66 mol 282 unq 1 iso 0 dist 7.71088 11.2986 8.76532 7.46064 6.33524 4.66602 6.7858 8.8673 8.14825 7.36881 4.90579 9.0975 8.12478 5.0324 5.50768 numMergedOcc 0
67 mol 282 unq 1 iso 1 dist 7.71088 7.46064 6.33524 11.2986 8.76532 4.66602 6.7858 8.8673 7.36881 8.14825 4.90579 9.0975 5.0324 8.12478 5.50768 numMergedOcc 0
