0 mol 16 unq 0 iso 0 dist 9.76968 4.2139 6.31718 12.1754 7.63133 10.8455 8.55371 5.47769 6.2983 5.94084 8.8641 6.92781 5.05803 12.5273 7.03948 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 9.76968 12.1754 7.63133 4.2139 6.31718 10.8455 8.55371 5.47769 5.94084 6.2983 13.862 5.32694 5.46498 10.9143 6.58035 numMergedOcc 0
2 mol 16 unq 2 iso 0 dist 9.76968 12.1754 7.63133 4.2139 6.31718 10.8455 8.55371 5.47769 5.94084 6.2983 19.1237 10.4155 8.71745 16.4009 12.1189 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 8.38387 11.8286 6.20293 11.0096 8.80331 8.13395 6.35048 9.83618 9.49077 10.4442 13.3732 5.06502 5.73819 10.5523 13.5377 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 8.38387 11.8286 6.20293 11.0096 8.80331 8.13395 6.35048 9.83618 9.49077 10.4442 12.9363 6.45462 8.93915 14.7803 13.7177 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 6.65344 13.1729 7.71095 5.29688 6.85766 10.0246 10.4897 6.71911 5.33688 7.29033 19.1673 12.5396 8.84665 17.79 12.8699 numMergedOcc 0
6 mol 59 unq 1 iso 0 dist 6.65344 13.1729 7.71095 5.29688 6.85766 10.0246 10.4897 6.71911 5.33688 7.29033 14.3301 8.19458 8.25513 14.0127 11.6249 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 5.02717 6.75472 5.83991 5.28901 7.30858 10.8507 9.81097 8.66155 6.09023 11.3902 12.5189 7.69052 9.33865 13.8473 9.66954 numMergedOcc 0
8 mol 115 unq 1 iso 0 dist 5.02717 6.75472 5.83991 11.0268 7.88312 8.02349 9.81097 8.66155 6.09023 4.61908 12.5189 7.69052 9.33865 6.11741 9.66954 numMergedOcc 0
9 mol 115 unq 2 iso 0 dist 5.02717 11.0268 7.88312 5.28901 7.30858 11.5723 9.81097 8.66155 4.61908 11.3902 12.5189 7.69052 6.11741 13.8473 9.66954 numMergedOcc 0
10 mol 115 unq 3 iso 0 dist 5.02717 11.0268 7.88312 6.75472 5.83991 8.02349 9.81097 8.66155 4.61908 6.09023 12.5189 7.69052 6.11741 9.33865 9.66954 numMergedOcc 0
11 mol 115 unq 4 iso 0 dist 4.98864 6.59772 6.11741 10.9437 7.88312 7.69052 5.46352 6.99777 10.8292 11.7126 12.6493 8.02349 9.33865 5.83991 13.9977 numMergedOcc 0
12 mol 115 unq 5 iso 0 dist 4.98864 6.59772 6.11741 10.9437 7.88312 7.69052 10.1017 9.14376 6.12943 4.62962 12.6493 8.02349 9.33865 5.83991 9.65429 numMergedOcc 0
13 mol 115 unq 6 iso 0 dist 4.98864 10.9437 7.88312 6.59772 6.11741 7.69052 5.46352 6.99777 11.7126 10.8292 14.1021 11.5723 7.30858 13.8473 11.695 numMergedOcc 0
14 mol 115 unq 7 iso 0 dist 4.98864 10.9437 7.88312 6.59772 6.11741 7.69052 5.46352 6.99777 11.7126 10.8292 12.6493 8.02349 5.83991 9.33865 13.9977 numMergedOcc 0
15 mol 115 unq 8 iso 0 dist 4.98864 10.9437 7.88312 6.59772 6.11741 7.69052 10.1017 9.14376 4.62962 6.12943 14.1021 11.5723 7.30858 13.8473 10.0603 numMergedOcc 0
16 mol 115 unq 9 iso 0 dist 4.98864 10.9437 7.88312 6.59772 6.11741 7.69052 10.1017 9.14376 4.62962 6.12943 12.6493 8.02349 5.83991 9.33865 9.65429 numMergedOcc 0
17 mol 115 unq 10 iso 0 dist 7.95871 4.86477 6.11741 12.0354 7.88312 7.69052 10.3995 6.99777 10.8292 11.7126 13.7044 8.02349 9.33865 5.83991 13.9977 numMergedOcc 0
18 mol 115 unq 11 iso 0 dist 7.95871 4.86477 6.11741 12.0354 7.88312 7.69052 9.81323 9.14376 6.12943 4.62962 13.7044 8.02349 9.33865 5.83991 9.65429 numMergedOcc 0
19 mol 115 unq 12 iso 0 dist 7.95871 12.0354 7.88312 4.86477 6.11741 7.69052 10.3995 6.99777 11.7126 10.8292 17.0624 11.5723 7.30858 13.8473 11.695 numMergedOcc 0
20 mol 115 unq 13 iso 0 dist 7.95871 12.0354 7.88312 4.86477 6.11741 7.69052 10.3995 6.99777 11.7126 10.8292 13.7044 8.02349 5.83991 9.33865 13.9977 numMergedOcc 0
21 mol 115 unq 14 iso 0 dist 7.95871 12.0354 7.88312 4.86477 6.11741 7.69052 9.81323 9.14376 4.62962 6.12943 17.0624 11.5723 7.30858 13.8473 10.0603 numMergedOcc 0
22 mol 115 unq 15 iso 0 dist 7.95871 12.0354 7.88312 4.86477 6.11741 7.69052 9.81323 9.14376 4.62962 6.12943 13.7044 8.02349 5.83991 9.33865 9.65429 numMergedOcc 0
23 mol 133 unq 0 iso 0 dist 5.86531 9.73435 8.00618 6.26797 7.11802 8.18495 5.80615 7.92688 12.2037 4.68409 15.5083 11.965 6.29155 13.268 17.2931 numMergedOcc 0
24 mol 133 unq 1 iso 0 dist 5.86531 9.73435 8.00618 6.26797 7.11802 8.18495 5.80615 7.92688 12.2037 4.68409 11.5178 7.79672 6.80239 12.6651 15.1694 numMergedOcc 0
25 mol 134 unq 0 iso 0 dist 9.92932 10.5108 8.94367 6.20443 9.86662 6.81259 6.27009 8.79571 5.41704 6.17103 9.60411 5.49782 6.37586 9.71307 5.42582 numMergedOcc 0
26 mol 134 unq 1 iso 0 dist 9.92932 10.5108 8.94367 6.20443 9.86662 6.81259 6.27009 8.79571 5.41704 6.17103 14.0674 8.80819 6.49416 12.5075 8.6355 numMergedOcc 0
27 mol 134 unq 2 iso 0 dist 9.92932 6.20443 9.86662 10.5108 8.94367 6.81259 6.27009 8.79571 6.17103 5.41704 9.60411 5.49782 9.71307 6.37586 5.42582 numMergedOcc 0
28 mol 134 unq 3 iso 0 dist 9.60411 10.5108 6.37586 6.20443 9.71307 6.81259 6.27009 5.42582 5.41704 6.17103 9.92932 5.49782 8.94367 9.86662 8.79571 numMergedOcc 0
29 mol 134 unq 4 iso 0 dist 9.60411 10.5108 6.37586 6.20443 9.71307 6.81259 6.27009 5.42582 5.41704 6.17103 14.0674 5.00817 6.49416 12.5075 8.6355 numMergedOcc 0
30 mol 134 unq 5 iso 0 dist 9.60411 6.20443 9.71307 10.5108 6.37586 6.81259 6.27009 5.42582 6.17103 5.41704 9.92932 5.49782 9.86662 8.94367 8.79571 numMergedOcc 0
31 mol 134 unq 6 iso 0 dist 9.55556 11.9294 8.94367 6.36794 9.86662 6.81259 10.2625 8.79571 5.41704 6.17103 12.1043 5.49782 6.37586 9.71307 5.42582 numMergedOcc 0
32 mol 134 unq 7 iso 0 dist 9.55556 11.9294 8.94367 6.36794 9.86662 6.81259 10.2625 8.79571 5.41704 6.17103 16.0579 8.80819 6.49416 12.5075 8.6355 numMergedOcc 0
33 mol 134 unq 8 iso 0 dist 9.55556 6.36794 9.86662 11.9294 8.94367 6.81259 10.2625 8.79571 6.17103 5.41704 12.1043 5.49782 9.71307 6.37586 5.42582 numMergedOcc 0
34 mol 152 unq 0 iso 0 dist 8.07256 11.1874 6.70283 10.4039 8.56324 7.65448 6.51591 9.13561 8.25411 5.99333 13.1529 5.42328 5.87555 10.399 12.4808 numMergedOcc 0
35 mol 152 unq 1 iso 0 dist 8.07256 11.1874 6.70283 10.4039 8.56324 7.65448 6.51591 9.13561 8.25411 5.99333 12.6103 6.4896 8.67331 14.1618 14.1119 numMergedOcc 0
36 mol 152 unq 2 iso 0 dist 8.07256 11.1874 6.70283 8.36099 7.16148 5.49936 6.51591 9.13561 8.25411 7.89109 13.1529 5.42328 5.87555 8.87437 12.4808 numMergedOcc 0
37 mol 152 unq 3 iso 0 dist 8.07256 11.1874 6.70283 8.36099 7.16148 5.49936 6.51591 9.13561 8.25411 7.89109 12.6103 6.4896 8.67331 8.05741 14.1119 numMergedOcc 0
38 mol 152 unq 4 iso 0 dist 8.07256 8.36099 7.16148 10.4039 8.56324 10.6875 6.51591 9.13561 7.89109 5.99333 13.1529 5.42328 8.87437 10.399 12.4808 numMergedOcc 0
39 mol 152 unq 5 iso 0 dist 8.07256 8.36099 7.16148 10.4039 8.56324 10.6875 6.51591 9.13561 7.89109 5.99333 12.6103 6.4896 8.05741 14.1618 14.1119 numMergedOcc 0
40 mol 152 unq 6 iso 0 dist 8.07256 8.36099 7.16148 11.1874 6.70283 5.49936 6.51591 9.13561 7.89109 8.25411 13.1529 5.42328 8.87437 5.87555 12.4808 numMergedOcc 0
41 mol 152 unq 7 iso 0 dist 8.07256 8.36099 7.16148 11.1874 6.70283 5.49936 6.51591 9.13561 7.89109 8.25411 12.6103 6.4896 8.05741 8.67331 14.1119 numMergedOcc 0
42 mol 224 unq 0 iso 0 dist 8.39002 5.72088 6.57273 9.98893 8.95269 4.70378 7.90095 6.87664 7.12232 7.98696 8.46129 5.0744 6.60589 9.99123 10.8259 numMergedOcc 0
43 mol 224 unq 1 iso 0 dist 8.39002 5.72088 6.57273 6.51315 5.78342 8.49799 7.90095 6.87664 7.12232 5.3621 8.46129 5.0744 6.60589 9.16166 10.8259 numMergedOcc 0
44 mol 224 unq 2 iso 0 dist 8.39002 6.51315 5.78342 9.98893 8.95269 11.5372 7.90095 6.87664 5.3621 7.98696 8.46129 5.0744 9.16166 9.99123 10.8259 numMergedOcc 0
45 mol 224 unq 3 iso 0 dist 8.39002 6.51315 5.78342 9.98893 8.95269 11.5372 7.90095 6.87664 5.3621 7.98696 9.2053 5.60236 5.81334 14.0676 10.2775 numMergedOcc 0
46 mol 224 unq 4 iso 0 dist 8.39002 6.51315 5.78342 5.72088 6.57273 8.49799 7.90095 6.87664 5.3621 7.12232 8.46129 5.0744 9.16166 6.60589 10.8259 numMergedOcc 0
47 mol 224 unq 5 iso 0 dist 8.39002 6.51315 5.78342 5.72088 6.57273 8.49799 7.90095 6.87664 5.3621 7.12232 9.2053 5.60236 5.81334 10.5128 10.2775 numMergedOcc 0
48 mol 234 unq 0 iso 0 dist 7.86368 12.0816 9.45496 6.94762 6.7625 7.82322 16.9465 9.5707 15.9563 14.4106 12.3151 5.88703 6.56247 9.36357 10.3388 numMergedOcc 0
49 mol 234 unq 1 iso 0 dist 7.86368 12.0816 9.45496 6.94762 6.7625 7.82322 15.442 7.85175 11.216 11.4315 12.3151 5.88703 6.56247 9.36357 6.25105 numMergedOcc 0
50 mol 234 unq 2 iso 0 dist 7.86368 6.94762 6.7625 12.0816 9.45496 7.82322 16.9465 9.5707 14.4106 15.9563 12.3151 5.88703 9.36357 6.56247 10.3388 numMergedOcc 0
51 mol 234 unq 3 iso 0 dist 7.86368 6.94762 6.7625 12.0816 9.45496 7.82322 15.442 7.85175 11.4315 11.216 12.3151 5.88703 9.36357 6.56247 6.25105 numMergedOcc 0
52 mol 236 unq 0 iso 0 dist 8.90987 5.26654 8.03456 3.82437 6.84306 5.79505 14.3961 7.17676 11.8759 11.3552 11.2664 7.28249 9.81562 7.68742 5.34718 numMergedOcc 0
53 mol 236 unq 1 iso 0 dist 8.90987 5.26654 8.03456 3.82437 6.84306 5.79505 12.7435 6.68463 9.07822 11.6837 11.2664 7.28249 9.81562 7.68742 10.5713 numMergedOcc 0
54 mol 236 unq 2 iso 0 dist 8.90987 5.26654 8.03456 13.8124 9.99038 9.90963 14.3961 7.17676 11.8759 6.04825 11.2664 7.28249 9.81562 6.27581 5.34718 numMergedOcc 0
55 mol 236 unq 3 iso 0 dist 8.90987 5.26654 8.03456 13.8124 9.99038 9.90963 12.7435 6.68463 9.07822 8.8265 11.2664 7.28249 9.81562 6.27581 10.5713 numMergedOcc 0
56 mol 236 unq 4 iso 0 dist 8.90987 5.26654 8.03456 11.2846 9.78037 6.96005 14.3961 7.17676 11.8759 12.6468 11.2664 7.28249 9.81562 13.499 5.34718 numMergedOcc 0
57 mol 236 unq 5 iso 0 dist 8.90987 5.26654 8.03456 11.2846 9.78037 6.96005 12.7435 6.68463 9.07822 5.80136 11.2664 7.28249 9.81562 13.499 10.5713 numMergedOcc 0
58 mol 236 unq 6 iso 0 dist 8.90987 5.26654 8.03456 16.8883 8.35971 14.2337 14.3961 7.17676 11.8759 6.40312 11.2664 7.28249 9.81562 11.2141 5.34718 numMergedOcc 0
59 mol 236 unq 7 iso 0 dist 8.90987 5.26654 8.03456 16.8883 8.35971 14.2337 12.7435 6.68463 9.07822 6.2568 11.2664 7.28249 9.81562 11.2141 10.5713 numMergedOcc 0
60 mol 236 unq 8 iso 0 dist 8.90987 3.82437 6.84306 5.26654 8.03456 5.79505 14.3961 7.17676 11.3552 11.8759 11.2664 7.28249 7.68742 9.81562 5.34718 numMergedOcc 0
61 mol 236 unq 9 iso 0 dist 8.90987 3.82437 6.84306 5.26654 8.03456 5.79505 12.7435 6.68463 11.6837 9.07822 11.2664 7.28249 7.68742 9.81562 10.5713 numMergedOcc 0
62 mol 236 unq 10 iso 0 dist 8.90987 3.82437 6.84306 13.8124 9.99038 11.3368 14.3961 7.17676 11.3552 6.04825 11.2664 7.28249 7.68742 6.27581 5.34718 numMergedOcc 0
63 mol 236 unq 11 iso 0 dist 8.90987 3.82437 6.84306 13.8124 9.99038 11.3368 12.7435 6.68463 11.6837 8.8265 11.2664 7.28249 7.68742 6.27581 10.5713 numMergedOcc 0
64 mol 236 unq 12 iso 0 dist 8.90987 3.82437 6.84306 11.2846 9.78037 11.8739 14.3961 7.17676 11.3552 12.6468 11.2664 7.28249 7.68742 13.499 5.34718 numMergedOcc 0
65 mol 236 unq 13 iso 0 dist 8.90987 3.82437 6.84306 11.2846 9.78037 11.8739 12.7435 6.68463 11.6837 5.80136 11.2664 7.28249 7.68742 13.499 10.5713 numMergedOcc 0
66 mol 236 unq 14 iso 0 dist 8.90987 3.82437 6.84306 16.8883 8.35971 14.7998 14.3961 7.17676 11.3552 6.40312 11.2664 7.28249 7.68742 11.2141 5.34718 numMergedOcc 0
67 mol 236 unq 15 iso 0 dist 8.90987 3.82437 6.84306 16.8883 8.35971 14.7998 12.7435 6.68463 11.6837 6.2568 11.2664 7.28249 7.68742 11.2141 10.5713 numMergedOcc 0
68 mol 236 unq 16 iso 0 dist 8.90987 13.8124 9.99038 5.26654 8.03456 9.90963 14.3961 7.17676 6.04825 11.8759 11.2664 7.28249 6.27581 9.81562 5.34718 numMergedOcc 0
69 mol 236 unq 17 iso 0 dist 8.90987 13.8124 9.99038 5.26654 8.03456 9.90963 12.7435 6.68463 8.8265 9.07822 11.2664 7.28249 6.27581 9.81562 10.5713 numMergedOcc 0
70 mol 236 unq 18 iso 0 dist 8.90987 13.8124 9.99038 3.82437 6.84306 11.3368 14.3961 7.17676 6.04825 11.3552 11.2664 7.28249 6.27581 7.68742 5.34718 numMergedOcc 0
71 mol 236 unq 19 iso 0 dist 8.90987 13.8124 9.99038 3.82437 6.84306 11.3368 12.7435 6.68463 8.8265 11.6837 11.2664 7.28249 6.27581 7.68742 10.5713 numMergedOcc 0
72 mol 236 unq 20 iso 0 dist 8.90987 13.8124 9.99038 11.2846 9.78037 11.1557 14.3961 7.17676 6.04825 12.6468 11.2664 7.28249 6.27581 13.499 5.34718 numMergedOcc 0
73 mol 236 unq 21 iso 0 dist 8.90987 13.8124 9.99038 11.2846 9.78037 11.1557 12.7435 6.68463 8.8265 5.80136 11.2664 7.28249 6.27581 13.499 10.5713 numMergedOcc 0
74 mol 236 unq 22 iso 0 dist 8.90987 13.8124 9.99038 16.8883 8.35971 10.7497 14.3961 7.17676 6.04825 6.40312 11.2664 7.28249 6.27581 11.2141 5.34718 numMergedOcc 0
75 mol 236 unq 23 iso 0 dist 8.90987 13.8124 9.99038 16.8883 8.35971 10.7497 12.7435 6.68463 8.8265 6.2568 11.2664 7.28249 6.27581 11.2141 10.5713 numMergedOcc 0
76 mol 236 unq 24 iso 0 dist 8.90987 16.8883 8.35971 5.26654 8.03456 14.2337 14.3961 7.17676 6.40312 11.8759 15.2598 7.43758 8.04248 15.1853 10.6445 numMergedOcc 0
77 mol 236 unq 25 iso 0 dist 8.90987 16.8883 8.35971 5.26654 8.03456 14.2337 12.7435 6.68463 6.2568 9.07822 15.2598 7.43758 8.04248 15.1853 10.5433 numMergedOcc 0
78 mol 236 unq 26 iso 0 dist 8.90987 16.8883 8.35971 3.82437 6.84306 14.7998 14.3961 7.17676 6.40312 11.3552 15.2598 7.43758 8.04248 13.5269 10.6445 numMergedOcc 0
79 mol 236 unq 27 iso 0 dist 8.90987 16.8883 8.35971 3.82437 6.84306 14.7998 12.7435 6.68463 6.2568 11.6837 15.2598 7.43758 8.04248 13.5269 10.5433 numMergedOcc 0
80 mol 236 unq 28 iso 0 dist 8.90987 16.8883 8.35971 13.8124 9.99038 10.7497 14.3961 7.17676 6.40312 6.04825 15.2598 7.43758 8.04248 15.7308 10.6445 numMergedOcc 0
81 mol 236 unq 29 iso 0 dist 8.90987 16.8883 8.35971 13.8124 9.99038 10.7497 12.7435 6.68463 6.2568 8.8265 15.2598 7.43758 8.04248 15.7308 10.5433 numMergedOcc 0
82 mol 236 unq 30 iso 0 dist 8.90987 16.8883 8.35971 11.2846 9.78037 12.0369 14.3961 7.17676 6.40312 12.6468 15.2598 7.43758 8.04248 14.9122 10.6445 numMergedOcc 0
83 mol 236 unq 31 iso 0 dist 8.90987 16.8883 8.35971 11.2846 9.78037 12.0369 12.7435 6.68463 6.2568 5.80136 15.2598 7.43758 8.04248 14.9122 10.5433 numMergedOcc 0
