0 mol 19 unq 0 iso 0 dist 8.4674 4.51865 5.80928 6.20943 5.14627 4.69858 8.40416 9.74255 7.08342 11.4087 4.64838 6.41575 6.41423 5.82366 9.95212 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 4.54938 7.20519 7.34551 8.78293 10.9543 5.31524 7.75618 9.74255 4.96411 6.2337 4.97119 6.41575 10.741 13.1234 9.95212 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 4.54938 7.20519 7.34551 8.23643 6.55187 11.0832 7.75618 9.74255 4.96411 14.4867 4.97119 6.41575 10.741 11.3136 9.95212 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 4.54938 7.20519 7.34551 7.82528 5.14627 10.4988 7.75618 9.74255 4.96411 11.4087 4.97119 6.41575 10.741 5.82366 9.95212 numMergedOcc 0
4 mol 19 unq 4 iso 0 dist 4.54938 6.864 5.80928 8.78293 10.9543 11.4401 7.75618 9.74255 7.08342 6.2337 4.97119 6.41575 6.41423 13.1234 9.95212 numMergedOcc 0
5 mol 19 unq 5 iso 0 dist 4.54938 6.864 5.80928 8.23643 6.55187 12.3093 7.75618 9.74255 7.08342 14.4867 4.97119 6.41575 6.41423 11.3136 9.95212 numMergedOcc 0
6 mol 19 unq 6 iso 0 dist 4.54938 6.864 5.80928 7.82528 5.14627 4.69858 7.75618 9.74255 7.08342 11.4087 4.97119 6.41575 6.41423 5.82366 9.95212 numMergedOcc 0
7 mol 19 unq 7 iso 0 dist 4.51865 8.4674 5.80928 6.20943 4.69858 5.14627 8.40416 7.08342 9.74255 11.4087 4.64838 6.41423 6.41575 5.82366 9.95212 numMergedOcc 0
8 mol 19 unq 8 iso 0 dist 4.51865 6.864 7.67038 8.58657 6.74265 5.5841 6.41423 4.64838 4.97119 5.90856 7.08342 8.40416 7.75618 7.02548 9.95212 numMergedOcc 0
9 mol 19 unq 9 iso 0 dist 6.864 7.20519 7.07775 8.78293 11.4401 5.31524 7.75618 7.08342 4.96411 6.2337 4.97119 6.41423 10.741 13.1234 9.95212 numMergedOcc 0
10 mol 19 unq 10 iso 0 dist 6.864 7.20519 7.07775 8.23643 12.3093 11.0832 7.75618 7.08342 4.96411 14.4867 4.97119 6.41423 10.741 11.3136 9.95212 numMergedOcc 0
11 mol 19 unq 11 iso 0 dist 6.864 7.20519 7.07775 7.82528 4.69858 10.4988 7.75618 7.08342 4.96411 11.4087 4.97119 6.41423 10.741 5.82366 9.95212 numMergedOcc 0
12 mol 19 unq 12 iso 0 dist 6.864 4.54938 5.80928 8.78293 11.4401 10.9543 7.75618 7.08342 9.74255 6.2337 4.97119 6.41423 6.41575 13.1234 9.95212 numMergedOcc 0
13 mol 19 unq 13 iso 0 dist 6.864 4.54938 5.80928 8.23643 12.3093 6.55187 7.75618 7.08342 9.74255 14.4867 4.97119 6.41423 6.41575 11.3136 9.95212 numMergedOcc 0
14 mol 19 unq 14 iso 0 dist 6.864 4.54938 5.80928 7.82528 4.69858 5.14627 7.75618 7.08342 9.74255 11.4087 4.97119 6.41423 6.41575 5.82366 9.95212 numMergedOcc 0
15 mol 19 unq 15 iso 0 dist 6.864 4.51865 7.67038 8.58657 5.5841 6.74265 6.41423 4.97119 4.64838 5.90856 7.08342 7.75618 8.40416 7.02548 9.95212 numMergedOcc 0
16 mol 25 unq 0 iso 0 dist 6.03987 7.31767 4.51512 7.685 10.3635 8.43188 8.6653 5.82503 5.64303 12.9735 5.68392 6.85556 9.79094 9.71382 12.0452 numMergedOcc 0
17 mol 54 unq 0 iso 0 dist 6.83299 9.5589 5.08001 5.02241 5.06052 6.91765 7.21717 13.86 15.293 11.0681 4.29856 6.14538 10.6808 6.30987 10.7227 numMergedOcc 0
18 mol 54 unq 1 iso 0 dist 6.83299 8.10861 14.2075 5.02241 5.06052 10.1332 7.21717 13.86 5.99981 11.0681 4.29856 6.14538 10.4158 6.30987 10.7227 numMergedOcc 0
19 mol 58 unq 0 iso 0 dist 6.86465 6.62496 5.30792 9.58673 5.92889 10.2241 8.80614 10.2049 9.95364 8.88332 5.78774 9.92355 5.93884 13.7654 10.2007 numMergedOcc 0
20 mol 58 unq 1 iso 0 dist 6.86465 6.35756 5.35073 9.58673 5.92889 7.05413 8.80614 10.2049 5.49591 8.88332 5.78774 9.92355 7.68678 13.7654 10.2007 numMergedOcc 0
21 mol 58 unq 2 iso 0 dist 6.62496 6.86465 5.30792 9.58673 10.2241 5.92889 8.80614 9.95364 10.2049 8.88332 5.78774 5.93884 9.92355 13.7654 10.2007 numMergedOcc 0
22 mol 58 unq 3 iso 0 dist 6.62496 6.35756 4.81926 9.58673 10.2241 7.05413 8.80614 9.95364 5.49591 8.88332 5.78774 5.93884 7.68678 13.7654 10.2007 numMergedOcc 0
23 mol 58 unq 4 iso 0 dist 6.35756 6.86465 5.35073 9.58673 7.05413 5.92889 8.80614 5.49591 10.2049 8.88332 5.78774 7.68678 9.92355 13.7654 10.2007 numMergedOcc 0
24 mol 58 unq 5 iso 0 dist 6.35756 6.62496 4.81926 9.58673 7.05413 10.2241 8.80614 5.49591 9.95364 8.88332 5.78774 7.68678 5.93884 13.7654 10.2007 numMergedOcc 0
25 mol 100 unq 0 iso 0 dist 7.17106 9.60661 11.5403 6.58204 5.01145 10.9608 7.01812 8.4128 5.80144 10.0891 10.6848 7.10378 14.8081 11.9163 9.5057 numMergedOcc 0
26 mol 100 unq 1 iso 0 dist 7.17106 9.35224 8.87654 6.58204 5.01145 5.69137 7.01812 8.4128 10.0456 10.0891 10.6848 7.10378 15.2289 11.9163 9.5057 numMergedOcc 0
27 mol 100 unq 2 iso 0 dist 7.47343 6.45675 5.33144 8.72704 10.1589 7.2495 7.38135 11.2312 7.11701 11.0949 12.2861 8.30845 10.6086 9.44658 17.21 numMergedOcc 0
28 mol 100 unq 3 iso 0 dist 7.47343 6.45675 5.33144 8.72704 10.1589 7.2495 7.38135 11.2312 7.11701 11.0949 15.5385 8.76378 13.2102 18.5425 18.3027 numMergedOcc 0
29 mol 100 unq 4 iso 0 dist 7.47343 8.86688 10.1407 8.72704 10.1589 15.9331 7.38135 11.2312 7.79768 11.0949 12.2861 8.30845 18.1777 9.44658 17.21 numMergedOcc 0
30 mol 100 unq 5 iso 0 dist 7.47343 8.86688 10.1407 8.72704 10.1589 15.9331 7.38135 11.2312 7.79768 11.0949 15.5385 8.76378 14.0386 18.5425 18.3027 numMergedOcc 0
31 mol 100 unq 6 iso 0 dist 7.47343 6.65086 8.8807 7.75343 15.209 10.9608 8.30845 12.2861 5.80144 10.0891 11.2312 7.38135 15.4031 18.081 17.21 numMergedOcc 0
32 mol 100 unq 7 iso 0 dist 7.47343 6.65086 8.8807 7.75343 15.209 10.9608 8.76378 15.5385 12.3577 4.44538 11.2312 7.38135 15.4031 18.081 18.3027 numMergedOcc 0
33 mol 100 unq 8 iso 0 dist 7.47343 6.56369 12.6515 7.75343 15.209 5.69137 8.30845 12.2861 10.0456 10.0891 11.2312 7.38135 17.2419 18.081 17.21 numMergedOcc 0
34 mol 100 unq 9 iso 0 dist 7.47343 6.56369 12.6515 7.75343 15.209 5.69137 8.76378 15.5385 4.97045 4.44538 11.2312 7.38135 17.2419 18.081 18.3027 numMergedOcc 0
35 mol 100 unq 10 iso 0 dist 7.47343 9.30209 13.887 7.75343 15.209 9.21622 8.30845 12.2861 6.70236 10.0891 11.2312 7.38135 19.8941 18.081 17.21 numMergedOcc 0
36 mol 100 unq 11 iso 0 dist 7.47343 9.30209 13.887 7.75343 15.209 9.21622 8.76378 15.5385 10.7791 4.44538 11.2312 7.38135 19.8941 18.081 18.3027 numMergedOcc 0
37 mol 134 unq 0 iso 0 dist 6.54501 6.49416 5.00526 8.6355 10.1448 5.41704 7.80532 7.41674 9.87376 14.1488 5.71679 7.69991 6.23142 8.73604 6.40575 numMergedOcc 0
38 mol 134 unq 1 iso 0 dist 6.49416 6.54501 5.00526 8.6355 5.41704 10.1448 7.80532 9.87376 7.41674 14.1488 5.71679 6.23142 7.69991 8.73604 6.40575 numMergedOcc 0
39 mol 156 unq 0 iso 0 dist 7.44554 8.94056 5.56175 6.27641 7.29758 8.67156 9.4013 5.71511 6.13574 5.05683 5.4555 9.44367 7.90267 5.81122 8.37434 numMergedOcc 0
40 mol 156 unq 1 iso 0 dist 7.44554 8.94056 5.56175 6.27641 7.29758 8.67156 9.4013 5.71511 6.13574 5.05683 11.9952 9.47433 14.7758 13.7525 14.1424 numMergedOcc 0
41 mol 156 unq 2 iso 0 dist 7.44554 9.83699 8.38403 6.27641 7.29758 4.53931 9.4013 5.71511 5.80008 5.05683 5.4555 9.44367 10.3379 5.81122 8.37434 numMergedOcc 0
42 mol 156 unq 3 iso 0 dist 7.44554 9.83699 8.38403 6.27641 7.29758 4.53931 9.4013 5.71511 5.80008 5.05683 11.9952 9.47433 13.0431 13.7525 14.1424 numMergedOcc 0
43 mol 156 unq 4 iso 0 dist 8.94056 7.44554 5.56175 6.27641 8.67156 7.29758 9.4013 6.13574 5.71511 5.05683 5.4555 7.90267 9.44367 5.81122 8.37434 numMergedOcc 0
44 mol 156 unq 5 iso 0 dist 8.94056 9.83699 11.2719 6.27641 8.67156 4.53931 9.4013 6.13574 5.80008 5.05683 5.4555 7.90267 10.3379 5.81122 8.37434 numMergedOcc 0
45 mol 181 unq 0 iso 0 dist 9.1374 5.98885 8.88798 6.94688 6.25083 5.86342 8.90963 8.91338 9.81073 4.43678 6.6251 6.2479 7.99195 9.06217 12.1629 numMergedOcc 0
46 mol 181 unq 1 iso 0 dist 9.1374 5.98885 8.88798 6.71012 4.77278 9.14057 8.90963 8.91338 9.81073 6.03415 6.6251 6.2479 7.99195 7.13252 12.1629 numMergedOcc 0
47 mol 181 unq 2 iso 0 dist 9.1374 9.15386 12.1628 6.94688 6.25083 6.80228 8.90963 8.91338 9.34211 4.43678 6.6251 6.2479 12.8533 9.06217 12.1629 numMergedOcc 0
48 mol 181 unq 3 iso 0 dist 9.1374 9.15386 12.1628 6.71012 4.77278 11.6919 8.90963 8.91338 9.34211 6.03415 6.6251 6.2479 12.8533 7.13252 12.1629 numMergedOcc 0
49 mol 181 unq 4 iso 0 dist 5.98885 9.1374 8.88798 6.94688 5.86342 6.25083 8.90963 9.81073 8.91338 4.43678 5.6044 9.72611 14.2254 10.3766 10.515 numMergedOcc 0
50 mol 181 unq 5 iso 0 dist 5.98885 9.1374 8.88798 6.94688 5.86342 6.25083 8.90963 9.81073 8.91338 4.43678 6.6251 7.99195 6.2479 9.06217 12.1629 numMergedOcc 0
51 mol 181 unq 6 iso 0 dist 5.98885 9.1374 8.88798 6.71012 9.14057 4.77278 8.90963 9.81073 8.91338 6.03415 5.6044 9.72611 14.2254 10.7723 10.515 numMergedOcc 0
52 mol 181 unq 7 iso 0 dist 5.98885 9.1374 8.88798 6.71012 9.14057 4.77278 8.90963 9.81073 8.91338 6.03415 6.6251 7.99195 6.2479 7.13252 12.1629 numMergedOcc 0
53 mol 181 unq 8 iso 0 dist 5.98885 9.15386 5.16002 6.94688 5.86342 6.80228 8.90963 9.81073 9.34211 4.43678 5.6044 9.72611 10.428 10.3766 10.515 numMergedOcc 0
54 mol 181 unq 9 iso 0 dist 5.98885 9.15386 5.16002 6.94688 5.86342 6.80228 8.90963 9.81073 9.34211 4.43678 6.6251 7.99195 12.8533 9.06217 12.1629 numMergedOcc 0
55 mol 181 unq 10 iso 0 dist 5.98885 9.15386 5.16002 6.71012 9.14057 11.6919 8.90963 9.81073 9.34211 6.03415 5.6044 9.72611 10.428 10.7723 10.515 numMergedOcc 0
56 mol 181 unq 11 iso 0 dist 5.98885 9.15386 5.16002 6.71012 9.14057 11.6919 8.90963 9.81073 9.34211 6.03415 6.6251 7.99195 12.8533 7.13252 12.1629 numMergedOcc 0
57 mol 181 unq 12 iso 0 dist 5.98885 9.09537 10.1912 7.20046 5.4601 6.14208 9.72611 5.6044 12.9468 9.87435 9.81073 8.90963 18.0578 13.6646 10.515 numMergedOcc 0
58 mol 181 unq 13 iso 0 dist 5.98885 9.09537 10.1912 7.20046 5.4601 6.14208 7.99195 6.6251 10.09 4.69841 9.81073 8.90963 18.0578 13.6646 12.1629 numMergedOcc 0
59 mol 181 unq 14 iso 0 dist 5.98885 9.09537 10.1912 7.13543 10.0524 5.95965 9.72611 5.6044 12.9468 14.6648 9.81073 8.90963 18.0578 15.9219 10.515 numMergedOcc 0
60 mol 181 unq 15 iso 0 dist 5.98885 9.09537 10.1912 7.13543 10.0524 5.95965 7.99195 6.6251 10.09 7.23063 9.81073 8.90963 18.0578 15.9219 12.1629 numMergedOcc 0
61 mol 181 unq 16 iso 0 dist 7.81386 7.63312 8.85576 7.98142 9.53462 9.60512 5.94469 7.77758 12.5387 8.93991 7.20191 9.39829 6.41453 13.5221 11.8933 numMergedOcc 0
62 mol 181 unq 17 iso 0 dist 7.81386 7.63312 8.85576 7.37327 11.1462 13.3389 5.94469 7.77758 12.5387 5.35588 7.20191 9.39829 6.41453 14.5372 11.8933 numMergedOcc 0
63 mol 181 unq 18 iso 0 dist 7.63312 7.81386 8.85576 7.98142 9.60512 9.53462 5.94469 12.5387 7.77758 8.93991 5.63555 5.9176 10.4943 5.97685 10.3104 numMergedOcc 0
64 mol 181 unq 19 iso 0 dist 7.63312 7.81386 8.85576 7.98142 9.60512 9.53462 5.94469 12.5387 7.77758 8.93991 7.20191 6.41453 9.39829 13.5221 11.8933 numMergedOcc 0
65 mol 181 unq 20 iso 0 dist 7.63312 7.81386 8.85576 7.37327 13.3389 11.1462 5.94469 12.5387 7.77758 5.35588 5.63555 5.9176 10.4943 8.9289 10.3104 numMergedOcc 0
66 mol 181 unq 21 iso 0 dist 7.63312 7.81386 8.85576 7.37327 13.3389 11.1462 5.94469 12.5387 7.77758 5.35588 7.20191 6.41453 9.39829 14.5372 11.8933 numMergedOcc 0
67 mol 204 unq 0 iso 0 dist 8.51516 7.10633 10.8344 5.90931 12.9483 5.09262 9.68728 10.8573 7.67571 11.145 5.86489 7.32294 11.5776 11.641 10.2072 numMergedOcc 0
68 mol 205 unq 0 iso 0 dist 7.26832 6.03031 7.38516 9.19704 6.23291 8.66809 6.03688 12.4957 8.15057 14.6029 10.3603 5.44002 12.3113 10.5073 15.3509 numMergedOcc 0
69 mol 205 unq 1 iso 0 dist 7.26832 7.80463 13.8543 9.19704 6.23291 13.231 6.03688 12.4957 6.09749 14.6029 10.3603 5.44002 17.9798 10.5073 15.3509 numMergedOcc 0
70 mol 264 unq 0 iso 0 dist 6.24356 9.361 10.3202 9.0012 5.12409 9.74238 7.16853 5.00209 11.1431 9.76317 7.52936 5.93616 13.2142 5.91213 10.3854 numMergedOcc 0
71 mol 264 unq 1 iso 0 dist 6.24356 9.361 10.3202 9.5784 9.67998 9.85579 7.16853 5.00209 11.1431 13.9064 7.52936 5.93616 13.2142 7.34094 10.3854 numMergedOcc 0
